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L-Tryptophan, N-benzoyl-.alpha.-methyl-, methyl ester
SpectraBase Compound ID GFArMXDk2qm
InChI InChI=1S/C20H20N2O3/c1-13-16(15-10-6-7-11-17(15)21-13)12-18(20(24)25-2)22-19(23)14-8-4-3-5-9-14/h3-11,18,21H,12H2,1-2H3,(H,22,23)/t18-/m0/s1
InChIKey VIUCTVVLLWJYTB-SFHVURJKSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6rFkhyGCT0
Name L-Tryptophan, N-benzoyl-.alpha.-methyl-, methyl ester
Alternate Name(s) (S)-N(2)-benzoyl-2-methyltryptophan-methylester Methyl (2S)-2-(benzoylamino)-3-(2-methyl-1H-indol-3-yl)propanoate Methyl (S)-[n(2)-benzoyl-2-methyl-2-amino-3-indolyl)]propanoate
CAS Registry Number 116139-87-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-13-16(15-10-6-7-11-17(15)21-13)12-18(20(24)25-2)22-19(23)14-8-4-3-5-9-14/h3-11,18,21H,12H2,1-2H3,(H,22,23)/t18-/m0/s1
InChIKey VIUCTVVLLWJYTB-SFHVURJKSA-N
Molecular Weight 336.391 g/mol
SMILES [nH]1c2c(c(C[C@](NC(=O)c3ccccc3)(C(=O)OC)[H])c1C)cccc2
SPLASH splash10-001i-1910000000-3edfbd680315f7228905
Source of Spectrum H-71-235-0
Wiley ID 1332509