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(Z)-2-[(4-Amino-2-oxo-pent-3-en-3-yl)-methyl]-5-methylcyclohexa-2,5-dien-1,4-dione
SpectraBase Compound ID BXds7Fyr4N4
InChI InChI=1S/C13H15NO3/c1-7-4-13(17)10(6-12(7)16)5-11(8(2)14)9(3)15/h4,6H,5,14H2,1-3H3/b11-8-
InChIKey FCNMYVPVAOGKLP-FLIBITNWSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMKqPWC1Ar4
Name (Z)-2-[(4-Amino-2-oxo-pent-3-en-3-yl)-methyl]-5-methylcyclohexa-2,5-dien-1,4-dione
Alternate Name(s) (Z)-2-(2-acetyl-3-aminobut-2-en-1-yl)-5-methylcyclohexa-2,5-diene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c1-7-4-13(17)10(6-12(7)16)5-11(8(2)14)9(3)15/h4,6H,5,14H2,1-3H3/b11-8-
InChIKey FCNMYVPVAOGKLP-FLIBITNWSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(200001)342_1_17
Molecular Weight 233.267 g/mol
SMILES N\C(=C\(CC=1C(C=C(C)C(=O)C1)=O)C(C)=O)C
SPLASH splash10-0006-9110000000-5cf37f4c1df439090f22
Source of Spectrum JF-342-22-9a
Wiley ID 1766810