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((3aS,7aS)-7a-Phenyl-octahydro-indol-1-yl)-acetic acid methyl ester
SpectraBase Compound ID CNmMtTKx7L0
InChI InChI=1S/C17H23NO2/c1-20-16(19)13-18-12-10-15-9-5-6-11-17(15,18)14-7-3-2-4-8-14/h2-4,7-8,15H,5-6,9-13H2,1H3/t15-,17+/m0/s1
InChIKey MBDMLMRRKQBLSI-DOTOQJQBSA-N
Mol Weight 273.38 g/mol
Molecular Formula C17H23NO2
Exact Mass 273.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4VCkmNaqSD0
Name ((3aS,7aS)-7a-Phenyl-octahydro-indol-1-yl)-acetic acid methyl ester
Alternate Name(s) Methyl (7a-phenyl-octahydroindol-1'-yl)acetate Methyl[(3aS,7aS)-7a-phenyloctahydro-1H-indol-1-yl]acetate
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Formula C17H23NO2
InChI InChI=1S/C17H23NO2/c1-20-16(19)13-18-12-10-15-9-5-6-11-17(15,18)14-7-3-2-4-8-14/h2-4,7-8,15H,5-6,9-13H2,1H3/t15-,17+/m0/s1
InChIKey MBDMLMRRKQBLSI-DOTOQJQBSA-N
Molecular Weight 273.376 g/mol
SMILES [C@@]12(N(CC[C@@]2(CCCC1)[H])CC(=O)OC)c1ccccc1
SPLASH splash10-001i-6090000000-53e861f02553066c7ae5
Source of Spectrum AH-135-965-3
Wiley ID 1576603