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(1S,3S)-Methyl 1-(3-acetoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
SpectraBase Compound ID 5Gz2ieJPlP1
InChI InChI=1S/C21H20N2O4/c1-12(24)27-14-7-5-6-13(10-14)19-20-16(11-18(23-19)21(25)26-2)15-8-3-4-9-17(15)22-20/h3-10,18-19,22-23H,11H2,1-2H3/t18-,19-/m0/s1
InChIKey DRSFVCNEVMDIOD-OALUTQOASA-N
Mol Weight 364.4 g/mol
Molecular Formula C21H20N2O4
Exact Mass 364.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bMWcGuYVlx
Name (1S,3S)-Methyl 1-(3-acetoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O4
InChI InChI=1S/C21H20N2O4/c1-12(24)27-14-7-5-6-13(10-14)19-20-16(11-18(23-19)21(25)26-2)15-8-3-4-9-17(15)22-20/h3-10,18-19,22-23H,11H2,1-2H3/t18-,19-/m0/s1
InChIKey DRSFVCNEVMDIOD-OALUTQOASA-N
Molecular Weight 364.401 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@](N[C@@](C2)(C(=O)OC)[H])(c1cc(OC(=O)C)ccc1)[H]
SPLASH splash10-03y0-0389000000-36db9dee2110de824939
Source of Spectrum QC-21-228-4b
Wiley ID 1688226