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1H-Pyrido[3,4-b]indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-methyl-2-(phenylmethoxy)-, ethyl ester, (1R-cis)-
SpectraBase Compound ID HQD3oGZEKpG
InChI InChI=1S/C22H24N2O3/c1-3-26-22(25)20-13-18-17-11-7-8-12-19(17)23-21(18)15(2)24(20)27-14-16-9-5-4-6-10-16/h4-12,15,20,23H,3,13-14H2,1-2H3/t15-,20+/m1/s1
InChIKey XIQNEZMCCISWNV-QRWLVFNGSA-N
Mol Weight 364.45 g/mol
Molecular Formula C22H24N2O3
Exact Mass 364.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoRMPaMfTJL
Name 1H-Pyrido[3,4-b]indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-methyl-2-(phenylmethoxy)-, ethyl ester, (1R-cis)-
CAS Registry Number 106268-37-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O3
InChI InChI=1S/C22H24N2O3/c1-3-26-22(25)20-13-18-17-11-7-8-12-19(17)23-21(18)15(2)24(20)27-14-16-9-5-4-6-10-16/h4-12,15,20,23H,3,13-14H2,1-2H3/t15-,20+/m1/s1
InChIKey XIQNEZMCCISWNV-QRWLVFNGSA-N
Molecular Weight 364.445 g/mol
SMILES [nH]1c2ccccc2c2c1[C@](N([C@@](C2)(C(=O)OCC)[H])OCc1ccccc1)(C)[H]
SPLASH splash10-0a4i-0982000000-da196efd8168d10a174a
Source of Spectrum J-52-558-7
Synonyms 1-Methyl-2-(benzyloxy)-3-(ethoxycarbonyl)-1,2,3,4-tetrahydro-.beta.-carboline (trans) Ethyl (1R,3S)-2-(benzyloxy)-1-methyl-2,3,4,9-tetrahydro-1H-.beta.-carboline-3-carboxylate
Wiley ID 1350990