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 14 results

Search term: TZPBMNKOLMSJPF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5448098

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10+,11-,13-/m1/s1
C13H16O8300.2613201700
133529

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10+,11-,13?/m1/s1
C13H16O8300.2613131601
5448097

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/p-1/t8-,9-,10+,11-,13-/m1/s1
C13H15O8299.25394400
5448104

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9+,10+,11+,13-/m1/s1
C13H16O8300.26132100
3788014

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)
C13H16O8300.261342100
5448100

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10+,11+,13-/m1/s1
C13H16O8300.26132100
5448102

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9+,10+,11-,13-/m1/s1
C13H16O8300.26132100
5448103

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/p-1/t8-,9+,10+,11+,13-/m1/s1
C13H15O8299.25391100
5448101

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/p-1/t8-,9+,10+,11-,13-/m1/s1
C13H15O8299.25391100
5448099

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/p-1/t8-,9-,10+,11+,13-/m1/s1
C13H15O8299.25391100
103884141

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10+,11-,13+/m1/s1
C13H16O8300.26131100
128918817

5 of 5 defined stereocentres - 5/5 defined

Non-standard isotope
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10+,11-,13-/m1/s1/i1D,2D,3D,4D
C13H12D4O8304.2861300
128935045

5 of 5 defined stereocentres - 5/5 defined

Non-standard isotope
InChI=1/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9+,10+,11-,13-/m1/s1/i1D,2D,3D,4D
C13H12D4O8304.2861100

Advertisement