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METHYL-(1R*,9AS*,9R*)-1-HYDROXY-1-METHYL-2,3,9,9A-TETRAHYDRO-1H-PYRROLO-[1,2-A]-INDOL-9-CARBOXYLATE
SpectraBase Compound ID AcclaKxOXoe
InChI InChI=1S/C14H17NO3/c1-14(17)7-8-15-10-6-4-3-5-9(10)11(12(14)15)13(16)18-2/h3-6,11-12,17H,7-8H2,1-2H3/t11-,12+,14-/m0/s1
InChIKey BLBGJTJXZNVELD-SCRDCRAPSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVGJoCZaWzA
Name (3S,8aR)-1-Hydroxy-1-methyl-2,3,9,9a-tetrahydro-1H-pyrrolo[1,2-a]indole-9-carboxylic acid (S)-methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-14(17)7-8-15-10-6-4-3-5-9(10)11(12(14)15)13(16)18-2/h3-6,11-12,17H,7-8H2,1-2H3/t11-,12+,14-/m0/s1
InChIKey BLBGJTJXZNVELD-SCRDCRAPSA-N
Molecular Weight 247.294 g/mol
SMILES O[C@@]1([C@]2([C@](C(=O)OC)([H])c3c(N2CC1)cccc3)[H])C
SPLASH splash10-0002-0930000000-09ac1f46ded506ff29b5
Source of Spectrum U1-2010-2727-32
Synonyms Methyl (1S*,9S*,9aR*)-1-Hydroxy-1-methyl-2,3,9,9a-tetrahydro-1H-pyrrolo[1,2-a]indole-9-carboxylate
Wiley ID 1663675