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 6 results

Search term: UJHKVYPPCJBOSG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8618954

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)
C13H18O3222.28026110300
35467290

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)/i2D3,3D3
C13H12D6O3228.31728800
8736612

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)/i1T,9T
C13H16T2O3226.29642100
34996002

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)/t9-/m0/s1
C13H18O3222.28022200
34996003

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)/t9-/m1/s1
C13H18O3222.28022200
58170364

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)/p-1
C13H17O3221.27281100

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