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 7 results

Search term: BKMMTJMQCTUHRP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4945

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3
C3H9NO75.1097143230169171
72545

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/t3-/m0/s1
C3H9NO75.10971421341517
72546

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/t3-/m1/s1
C3H9NO75.10971309002
24532018

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/t3-/m0/s1/i1D3
C3H6D3NO78.12818900
49071416

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/t3-/m1/s1/i1+1,2+1,3+1
13C3H9NO78.08765400
5360720

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/p+1/t3-/m0/s1
C3H10NO76.11714400
5366507

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/p+1/t3-/m1/s1
C3H10NO76.11711100

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