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: XSVMFMHYUFZWBK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
70377

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1
C14H22N2O2250.336710618791714
4899

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3
C14H22N2O2250.33675854900
23246169

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m1/s1
C14H22N2O2250.3367282300
8905128

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/i3D3,4D3
C14H16D6N2O2256.37378800
8952807

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1/i3D3,4D3
C14H16D6N2O2256.37374300
9023720

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1/i11+2
C1314CH22N2O2252.32922100
21234628

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/p+1/t11-/m0/s1
C14H23N2O2251.34412100
8762301

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1/i10T
C14H21TN2O2252.34482200
107449068

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1/i3D2,4D2
C14H18D4N2O2254.36131300
114553495

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m1/s1/i1D3,6D2
C14H17D5N2O2255.36751100
114553496

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m1/s1/i5D3
C14H19D3N2O2253.35521100
117232021

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m1/s1/i3D3,4D3
C14H16D6N2O2256.37371100

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