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 9 results

Search term: JQAOHGMPAAWWQO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
505724

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
C11H19NO4229.272914912600
600037

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m0/s1
C11H19NO4229.27291277200
600038

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m1/s1
C11H19NO4229.27291277500
5296722

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/p-1/t8-/m0/s1
C11H18NO4228.264923200
8712819

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m1/s1/i9+1
C1013CH19NO4230.26552100
8832440

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m0/s1/i9+1
C1013CH19NO4230.26552100
8880023

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m1/s1/i9+2
C1014CH19NO4231.26542100
9022410

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m0/s1/i9+2
C1014CH19NO4231.26542100
5296721

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/p-1/t8-/m1/s1
C11H18NO4228.264921100

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