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 12 results

Search term: WVHAUDNUGBNUDZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
78692

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8-,9+,10-,12+/m0/s1
C12H14O7270.2354454500
106521

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8-,9+,10-,12?/m0/s1
C12H14O7270.2354115300
2759875

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)
C12H14O7270.235367800
168168

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8-,9+,10+,12+/m0/s1
C12H14O7270.23543300
34450913

5 of 5 defined stereocentres - 5/5 defined

Non-standard isotope
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8-,9+,10-,12+/m0/s1/i1D,2D,3D,4D,5D
C12H9D5O7275.26623400
64872710

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8-,9-,10-,12+/m0/s1
C12H14O7270.23541100
117033498

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8+,9-,10+,12-/m1/s1
C12H14O7270.23541100
128924686

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8+,9+,10-,12+/m0/s1
C12H14O7270.23541100
5505613

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/p-1/t7-,8-,9+,10-,12+/m0/s1
C12H13O7269.2281100

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