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(1S,3S)-2-Benzyl-3-cyanomethyl-1-[2-(tert-butyldiphenylsilyloxy)ethyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SpectraBase Compound ID CboSJmlobYq
InChI InChI=1S/C38H41N3OSi/c1-38(2,3)43(31-17-9-5-10-18-31,32-19-11-6-12-20-32)42-26-24-36-37-34(33-21-13-14-22-35(33)40-37)27-30(23-25-39)41(36)28-29-15-7-4-8-16-29/h4-22,30,36,40H,23-24,26-28H2,1-3H3/t30-,36+/m1/s1
InChIKey NGDQGMPLWKSUBJ-GERKYKROSA-N
Mol Weight 583.9 g/mol
Molecular Formula C38H41N3OSi
Exact Mass 583.301889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGeOKWajOzd
Name (1S,3S)-2-Benzyl-3-cyanomethyl-1-[2-(tert-butyldiphenylsilyloxy)ethyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Alternate Name(s) [(1S,3S)-2-benzyl-1-(2-{[tert-butyl(diphenyl)silyl]oxy}ethyl)-2,3,4,9-tetrahydro-1H-.beta.-carbolin-3-yl]acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H41N3OSi
InChI InChI=1S/C38H41N3OSi/c1-38(2,3)43(31-17-9-5-10-18-31,32-19-11-6-12-20-32)42-26-24-36-37-34(33-21-13-14-22-35(33)40-37)27-30(23-25-39)41(36)28-29-15-7-4-8-16-29/h4-22,30,36,40H,23-24,26-28H2,1-3H3/t30-,36+/m1/s1
InChIKey NGDQGMPLWKSUBJ-GERKYKROSA-N
Molecular Weight 583.851 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@](N([C@@](C2)(CC#N)[H])Cc1ccccc1)(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)[H]
SPLASH splash10-0002-5904000000-871d8438cc741c88d037
Source of Spectrum KC-0-3580-0
Wiley ID 831965