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2-Pentenedioic acid, 3-chloro-, 5-methyl 1-[1-methyl-3-(2-thienyl)-2-propenyl]ester, (E,Z)-
SpectraBase Compound ID E5Swy8WUNrE
InChI InChI=1S/C14H15ClO4S/c1-10(5-6-12-4-3-7-20-12)19-14(17)9-11(15)8-13(16)18-2/h3-7,9-10H,8H2,1-2H3/b6-5-,11-9+
InChIKey DDTGWCSSKDQXEP-QEYVUMQQSA-N
Mol Weight 314.78 g/mol
Molecular Formula C14H15ClO4S
Exact Mass 314.037958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJTjlE0wCeu
Name 2-Pentenedioic acid, 3-chloro-, 5-methyl 1-[1-methyl-3-(2-thienyl)-2-propenyl]ester, (E,Z)-
CAS Registry Number 97602-93-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15ClO4S
InChI InChI=1S/C14H15ClO4S/c1-10(5-6-12-4-3-7-20-12)19-14(17)9-11(15)8-13(16)18-2/h3-7,9-10H,8H2,1-2H3/b6-5-,11-9+
InChIKey DDTGWCSSKDQXEP-QEYVUMQQSA-N
Molecular Weight 314.783 g/mol
SMILES C(\C=C/(CC(=O)OC)Cl)(OC(\C=C/c1sccc1)C)=O
SPLASH splash10-03dr-2907000000-7da8c23f86849071a192
Source of Spectrum KC-1985-754-22
Synonyms 4-(2-Thienyl)but-3-en-2-yl 3-chloro-4-methoxycarbonylbut-2-enoate 5-Methyl 1-[(2Z)-1-methyl-3-(2-thienyl)-2-propenyl](2E)-3-chloro-2-pentenedioate
Wiley ID 1314720