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: MXLMTQWGSQIYOW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
11239


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3
C5H12O88.14829616423128
5367305

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3/t5-/m0/s1
C5H12O88.1482473729
553660

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3/t5-/m1/s1
C5H12O88.1482463203
9993698

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3/i3D3
C5H9D3O91.16672100
107436807

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3/i1D3,2D3,4D
C5H5D7O95.19132200

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