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 10 results

Search term: LJCWONGJFPCTTL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
81106

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m1/s1
C8H9NO3167.16211811000
33241

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m0/s1
C8H9NO3167.16211410700
83189

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)
C8H9NO3167.162105142310
48060174

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m1/s1/i1D,2D,3D,4D
C8H5D4NO3171.18665400
60497981

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m1/s1/i1D,2D,3D,4D,7D
C8H4D5NO3172.19282300
60597030

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m0/s1/i3D,4D
C8H7D2NO3169.17432100
107438918

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/i1+1,2+1,3+1,4+1,5+1,6+1
C213C6H9NO3173.11791100
107449196

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m1/s1/i1+1,2+1,3+1,4+1,5+1,6+1
C213C6H9NO3173.11791100

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