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 8 results

Search term: JACRWUWPXAESPB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10274


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)
C9H10O3166.173914621077270
558481

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m0/s1
C9H10O3166.1739343600
686778

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m1/s1
C9H10O3166.1739343400
4573754

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/p-1
C9H9O3165.16655600
8617494

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m1/s1/i8+1,9+1
C713C2H10O3168.15922100
13102752

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m0/s1/i8+1,9+1
C713C2H10O3168.15921100
5316929

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/p-1/t8-/m1/s1
C9H9O3165.165961100
5316930

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/p-1/t8-/m0/s1
C9H9O3165.165961100

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