Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 75 results

Search term: OUYCCCASQSFEME (Found by InChIKey (skeleton match))
1234
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5833


1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1
C9H11NO3181.18851727871134795001
1121


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)
C9H11NO3181.1885163640071134794957
64252

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m1/s1
C9H11NO3181.1885130222637132
8595321

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1D,2D,3D,4D
C9H7D4NO3185.2132243119
28295825

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i10+1
C9H1115NO3182.1819222600
9994355

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i3D,4D
C9H9D2NO3183.20091725014
17345080

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1
13C9H1115NO3191.1158162200
21170369

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1+1,2+1,3+1,4+1,6+1,7+1
C313C6H11NO3187.1445152300
8437253

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1D,2D
C9H9D2NO3183.20091518013
17341156

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i5D2
C9H9D2NO3183.2009141600
17341291

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1
13C9H11NO3190.1224131700
21169762

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i9+1
C813CH11NO3182.1812131800
21170349

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/i10+1
C9H1115NO3182.1819131800
17341129

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/i5+1
C813CH11NO3182.1812131700
21170348

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i5+1
C813CH11NO3182.1812121500
8461308

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/i9+1
C813CH11NO3182.1812101200
118646

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i3T,4T
C9H9T2NO3185.20489900
8688767

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1D,2D,3D,4D,5D2,8D
C9H4D7NO3188.231791000
24532657

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/i1D,2D,3D,4D,5D2,8D
C9H4D7NO3188.231791100
28295713

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m1/s1/i1D,2D,3D,4D
C9H7D4NO3185.213291200
1234

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