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 19 results

Search term: SIXFVXJMCGPTRB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
72380

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12-,13-/m1/s1
C13H18O7286.2778786700
9475620

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10+,11+,12-,13-/m1/s1
C13H18O7286.2778583400
19367709

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12+,13+/m1/s1
C13H18O7286.2778342500
337197

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3
C13H18O7286.277811900
8260902

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12-,13+/m1/s1
C13H18O7286.27782100
8577269

5 of 5 defined stereocentres - 5/5 defined

Non-standard isotope
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12-,13+/m1/s1/i1+2
C1214CH18O7288.27042200
71116636

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9?,10-,11+,12?,13+/m0/s1
C13H18O7286.27781100
71116637

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9?,10-,11-,12?,13-/m1/s1
C13H18O7286.27781100
71116638

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9?,10-,11-,12?,13+/m1/s1
C13H18O7286.27781100
78424183

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12-,13?/m0/s1
C13H18O7286.27781100
95504839

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12+,13?/m1/s1
C13H18O7286.27781100
113607862

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11-,12-,13-/m0/s1
C13H18O7286.27781100
113607900

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10+,11-,12+,13+/m0/s1
C13H18O7286.27781100
113607901

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11-,12+,13+/m0/s1
C13H18O7286.27781100
114101201

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12-,13-/m0/s1
C13H18O7286.27781100
114642534

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12+,13-/m1/s1
C13H18O7286.27781100
114753151

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9?,10-,11?,12+,13-/m1/s1
C13H18O7286.27781100
115271598

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11-,12+,13+/m1/s1
C13H18O7286.27781200

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