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(Z)-N-Acetyl-1-benzyl-2-ethoxycarbonyldehydrotryptophan Methyl ester
SpectraBase Compound ID BD6GGlbNJnF
InChI InChI=1S/C24H24N2O5/c1-4-31-24(29)22-19(14-20(23(28)30-3)25-16(2)27)18-12-8-9-13-21(18)26(22)15-17-10-6-5-7-11-17/h5-14H,4,15H2,1-3H3,(H,25,27)/b20-14-
InChIKey OLEAUVFPOUHIDN-ZHZULCJRSA-N
Mol Weight 420.47 g/mol
Molecular Formula C24H24N2O5
Exact Mass 420.168522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24xxfGhzXIU
Name (Z)-N-Acetyl-1-benzyl-2-ethoxycarbonyldehydrotryptophan Methyl ester
Alternate Name(s) 3-[(Z)-2-acetamido-3-methoxy-3-oxoprop-1-enyl]-1-(phenylmethyl)-2-indolecarboxylic acid ethyl ester ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxoprop-1-enyl]-1-benzylindole-2-carboxylate ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxo-prop-1-enyl]-1-benzyl-indole-2-carboxylate ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxidanylidene-prop-1-enyl]-1-(phenylmethyl)indole-2-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24N2O5
InChI InChI=1S/C24H24N2O5/c1-4-31-24(29)22-19(14-20(23(28)30-3)25-16(2)27)18-12-8-9-13-21(18)26(22)15-17-10-6-5-7-11-17/h5-14H,4,15H2,1-3H3,(H,25,27)/b20-14-
InChIKey OLEAUVFPOUHIDN-ZHZULCJRSA-N
Molecular Weight 420.465 g/mol
SMILES N(\C(=C/c1c([n](c2c1cccc2)Cc1ccccc1)C(=O)OCC)C(=O)OC)C(=O)C
SPLASH splash10-006x-9000800000-508b35f7e57260376140
Source of Spectrum E1-42-837-18
Wiley ID 1552499