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trans-(1S,3R)-Methyl 1-isopropyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
SpectraBase Compound ID LU5Y8Xf36fr
InChI InChI=1S/C16H20N2O2/c1-9(2)14-15-11(8-13(18-14)16(19)20-3)10-6-4-5-7-12(10)17-15/h4-7,9,13-14,17-18H,8H2,1-3H3/t13-,14+/m1/s1
InChIKey JYDHUPQJWUFVGK-KGLIPLIRSA-N
Mol Weight 272.35 g/mol
Molecular Formula C16H20N2O2
Exact Mass 272.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eyrwj13rHLg
Name trans-(1S,3R)-Methyl 1-isopropyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
Alternate Name(s) (1S,3R)-1-propan-2-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester Methyl (1S,3R)-1-isopropyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate Methyl (1S,3R)-1-propan-2-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
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Formula C16H20N2O2
InChI InChI=1S/C16H20N2O2/c1-9(2)14-15-11(8-13(18-14)16(19)20-3)10-6-4-5-7-12(10)17-15/h4-7,9,13-14,17-18H,8H2,1-3H3/t13-,14+/m1/s1
InChIKey JYDHUPQJWUFVGK-KGLIPLIRSA-N
Molecular Weight 272.348 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@](N[C@](C2)(C(=O)OC)[H])(C(C)C)[H]
SPLASH splash10-004i-0390000000-333d58149bdd527346a8
Source of Spectrum QC-20-436-2i
Wiley ID 1688024