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(Z)-2-{[4-(N-Benzylamino)-2-oxo-pent-3-en-3-yl]-methyl}-5-methyl-cyclohexa-2,5-dien-1,4-dione
SpectraBase Compound ID AZouYTSri2b
InChI InChI=1S/C20H21NO3/c1-13-9-20(24)17(11-19(13)23)10-18(15(3)22)14(2)21-12-16-7-5-4-6-8-16/h4-9,11,21H,10,12H2,1-3H3/b18-14-
InChIKey PJQCVQCRDFUTOD-JXAWBTAJSA-N
Mol Weight 323.39 g/mol
Molecular Formula C20H21NO3
Exact Mass 323.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ad3jb4fuXXj
Name (Z)-2-{[4-(N-Benzylamino)-2-oxo-pent-3-en-3-yl]-methyl}-5-methyl-cyclohexa-2,5-dien-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO3
InChI InChI=1S/C20H21NO3/c1-13-9-20(24)17(11-19(13)23)10-18(15(3)22)14(2)21-12-16-7-5-4-6-8-16/h4-9,11,21H,10,12H2,1-3H3/b18-14-
InChIKey PJQCVQCRDFUTOD-JXAWBTAJSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(200001)342_1_17
Molecular Weight 323.392 g/mol
SMILES N(\C(=C/(C(C)=O)CC=1C(C=C(C(C1)=O)C)=O)C)Cc1ccccc1
SPLASH splash10-0006-9000000000-8eda0cd590ea26463360
Source of Spectrum JF-342-22-9c
Synonyms (Z)-2-(2-acetyl-3-(benzylamino)but-2-en-1-yl)-5-methylcyclohexa-2,5-diene-1,4-dione
Wiley ID 1766812