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
Additional Filters

Found 14 results

Search term: HXEACLLIILLPRG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
826


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)
C6H11NO2129.157203486511279
388365

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1
C6H11NO2129.1571421699699
643442

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m1/s1
C6H11NO2129.1571369500
17341274

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/i6+1
C513CH11NO2130.1497121200
24532863

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/i1D2,2D2,3D2,4D2,5D
C6H2D9NO2138.2125111400
31047109

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/i1D2,2D2,3D2,4D2/hD
C6H2D9NO2138.21255500
11178734

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/p-1
C6H10NO2128.14964108144
4573838

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/p-1/t5-/m0/s1
C6H10NO2128.14964503
4573977

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/p-1/t5-/m1/s1
C6H10NO2128.14962200
8758201

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1/i5+2,6+2
C414C2H11NO2133.14212100
8805876

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1/i6+1
C513CH11NO2130.14972100
8853620

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1/i6+2
C514CH11NO2131.14962100
8900711

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m1/s1/i6+1
C513CH11NO2130.14972100
8972077

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m1/s1/i6+2
C514CH11NO2131.14962100

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