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 6 results

Search term: HZGRVVUQEIBCMS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
91897

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C9H13NO2/c1-10-6-2-4-7(9(11)12)8(10)5-3-6/h4,6,8H,2-3,5H2,1H3,(H,11,12)
C9H13NO2167.205244000
9739455

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H13NO2/c1-10-6-2-4-7(9(11)12)8(10)5-3-6/h4,6,8H,2-3,5H2,1H3,(H,11,12)/t6-,8-/m1/s1
C9H13NO2167.205172000
34983880

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H13NO2/c1-10-6-2-4-7(9(11)12)8(10)5-3-6/h4,6,8H,2-3,5H2,1H3,(H,11,12)/t6-,8-/m0/s1
C9H13NO2167.2053300
8074589

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H13NO2/c1-10-6-2-4-7(9(11)12)8(10)5-3-6/h4,6,8H,2-3,5H2,1H3,(H,11,12)/t6-,8+/m0/s1
C9H13NO2167.2052100
58782115

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C9H13NO2/c1-10-6-2-4-7(9(11)12)8(10)5-3-6/h4,6,8H,2-3,5H2,1H3,(H,11,12)/i1D3
C9H10D3NO2170.22351100
76920185

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C9H13NO2/c1-10-6-2-4-7(9(11)12)8(10)5-3-6/h4,6,8H,2-3,5H2,1H3,(H,11,12)/t6-,8-/m1/s1/i1D3
C9H10D3NO2170.22351100

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