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 11 results

Search term: KBOJOGQFRVVWBH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
68142

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m0/s1
C8H11N3O3197.1912751741723
240418

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)
C8H11N3O3197.191248653725
28601394

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m1/s1
C8H11N3O3197.1912271800
107444944

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m1/s1/i9+1
C8H11N215NO3198.18462200
107444945

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m1/s1/i10+1
C8H11N215NO3198.18462200
8234141

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m1/s1/i2D,7D/t2-,7-
C8H9D2N3O3199.20362100
8257012

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m0/s1/i2D,7D/t2-,7-
C8H9D2N3O3199.20362100
23629553

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/i7D
C8H10DN3O3198.19741100
26330909

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/p-1/t7-/m0/s1
C8H10N3O3196.18381100
111312041

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m0/s1/i10+1
C8H11N215NO3198.18461100
111313863

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m0/s1/i9+1
C8H11N215NO3198.18461100

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