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N-(Methylene-4-oxocoumarinyl)tryptophan
SpectraBase Compound ID HL5TXVmpv5V
InChI InChI=1S/C21H16N2O5/c1-11-17(12-6-2-4-8-15(12)23-11)18(20(25)26)22-10-14-19(24)13-7-3-5-9-16(13)28-21(14)27/h2-10,18,22-23H,1H3,(H,25,26)/b14-10-
InChIKey SJMAGPFDMUZUDP-UVTDQMKNSA-N
Mol Weight 376.37 g/mol
Molecular Formula C21H16N2O5
Exact Mass 376.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKaJNOZDCz2
Name N-(Methylene-4-oxocoumarinyl)tryptophan
Alternate Name(s) {[2,4-Dioxo-chroman-(3Z)-ylidenemethyl]-amino}-(2-methyl-1H-indol-3-yl)-acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O5
InChI InChI=1S/C21H16N2O5/c1-11-17(12-6-2-4-8-15(12)23-11)18(20(25)26)22-10-14-19(24)13-7-3-5-9-16(13)28-21(14)27/h2-10,18,22-23H,1H3,(H,25,26)/b14-10-
InChIKey SJMAGPFDMUZUDP-UVTDQMKNSA-N
Molecular Weight 376.368 g/mol
SMILES N(C(C(=O)O)c1c([nH]c2c1cccc2)C)\C=C/1C(Oc2c(C1=O)cccc2)=O
SPLASH splash10-006x-9500000000-fa2c423d19d2faf04f28
Source of Spectrum Y-29-1818-7
Wiley ID 1357716