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: AFHDYMGMZUYZQT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
140806

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H16O3/c1-2-3-8-4-7-11(15-8)12-9(13)5-6-10(12)14/h8H,2-7H2,1H3/t8-/m0/s1
C12H16O3208.2536191764
288018

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H16O3/c1-2-3-8-4-7-11(15-8)12-9(13)5-6-10(12)14/h8H,2-7H2,1H3
C12H16O3208.2536161900
8688127

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C12H16O3/c1-2-3-8-4-7-11(15-8)12-9(13)5-6-10(12)14/h8H,2-7H2,1H3/t8-/m0/s1/i5D2,6D2
C12H12D4O3212.27832100
8807850

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C12H16O3/c1-2-3-8-4-7-11(15-8)12-9(13)5-6-10(12)14/h8H,2-7H2,1H3/t8-/m0/s1/i1+1,2+1,3+1,4+1,7+1,8+1,11+1,12+1
C413C8H16O3216.19492100
8926335

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C12H16O3/c1-2-3-8-4-7-11(15-8)12-9(13)5-6-10(12)14/h8H,2-7H2,1H3/t8-/m0/s1/i2+1,7+1,8+1,12+1
C813C4H16O3212.22432200
9021383

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C12H16O3/c1-2-3-8-4-7-11(15-8)12-9(13)5-6-10(12)14/h8H,2-7H2,1H3/t8-/m0/s1/i8D
C12H15DO3209.25982200

Advertisement