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
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Found 8 results

Search term: QLHULAHOXSSASE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
111359

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3
C12H23NO3229.315999123374
107433344

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/i2D3
C12H20D3NO3232.33445800
34992474

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/t10-,11+/m1/s1
C12H23NO3229.31593300
95643521

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/i14D
C12H22DNO3230.32211100
110406322

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/i12+2
C1114CH23NO3231.30851100
34992471

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/t10-,11-/m1/s1
C12H23NO3229.31591100
34992472

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/t10-,11-/m0/s1
C12H23NO3229.31591100
34992473

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/t10-,11+/m0/s1
C12H23NO3229.31591100

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