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N(2)-Benzyloxycarbonyl-N(1)-[2-(1H-indol-3'-yl)ethyl]glutaminamide
SpectraBase Compound ID 54m4gbSJaY0
InChI InChI=1S/C23H26N4O4/c24-21(28)11-10-20(27-23(30)31-15-16-6-2-1-3-7-16)22(29)25-13-12-17-14-26-19-9-5-4-8-18(17)19/h1-9,14,20,26H,10-13,15H2,(H2,24,28)(H,25,29)(H,27,30)/t20-/m0/s1
InChIKey HLCIWGRUWXCDNI-FQEVSTJZSA-N
Mol Weight 422.49 g/mol
Molecular Formula C23H26N4O4
Exact Mass 422.195405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nkSuLpicPY
Name N(2)-Benzyloxycarbonyl-N(1)-[2-(1H-indol-3'-yl)ethyl]glutaminamide
Alternate Name(s) benzyl (1S)-4-amino-1-({[2-(1H-indol-3-yl)ethyl]amino}carbonyl)-4-oxobutylcarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N4O4
InChI InChI=1S/C23H26N4O4/c24-21(28)11-10-20(27-23(30)31-15-16-6-2-1-3-7-16)22(29)25-13-12-17-14-26-19-9-5-4-8-18(17)19/h1-9,14,20,26H,10-13,15H2,(H2,24,28)(H,25,29)(H,27,30)/t20-/m0/s1
InChIKey HLCIWGRUWXCDNI-FQEVSTJZSA-N
Molecular Weight 422.485 g/mol
SMILES [nH]1c2c(c(CCNC([C@](CCC(=O)N)(NC(=O)OCc3ccccc3)[H])=O)c1)cccc2
SPLASH splash10-056u-9700000000-30ca9d508e0502583a03
Source of Spectrum H-77-968-44
Wiley ID 1378596