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A,2-Dichloro-5-(4,5,6,7-tetrahydro-phthalimido)-cinnamic acid, ethyl ester
SpectraBase Compound ID LPbLWnEcOl9
InChI InChI=1S/C19H17Cl2NO4/c1-2-26-19(25)16(21)10-11-9-12(7-8-15(11)20)22-17(23)13-5-3-4-6-14(13)18(22)24/h7-10H,2-6H2,1H3/b16-10-
InChIKey NNKKTZOEKDFTBU-YBEGLDIGSA-N
Mol Weight 394.25 g/mol
Molecular Formula C19H17Cl2NO4
Exact Mass 393.053463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1dfLanm3Ov5
Name Cinidon ethyl
Source of Sample Sigma-Aldrich Cat. #46336
CAS Registry Number 142891-20-1
Classification Pesticides: Herbicides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 393.053463427 u
Formula C19H17Cl2NO4
InChI InChI=1S/C19H17Cl2NO4/c1-2-26-19(25)16(21)10-11-9-12(7-8-15(11)20)22-17(23)13-5-3-4-6-14(13)18(22)24/h7-10H,2-6H2,1H3/b16-10-
InChIKey NNKKTZOEKDFTBU-YBEGLDIGSA-N
Molecular Weight 394.254 g/mol
Number of Peaks 49
RI1 3191
SMILES c1(Cl)c(cc(N2C(=O)C=3CCCCC3C2=O)cc1)\C=C\(Cl)C(=O)OCC
SPLASH splash10-001i-2009000000-ec9262bf632f46c72bbd
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Propenoic acid, 2-chloro-3-[2-chloro-5-(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)phenyl]-, ethyl ester, (2Z)-
Wiley ID LM_PEST_541