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2-Pentenedioic acid, 3-chloro-, 1-[3-(2-furanyl)-1-methyl-2-propenyl]5-methyl ester, (E,E)-
SpectraBase Compound ID A8GXXgxxRgf
InChI InChI=1S/C14H15ClO5/c1-10(5-6-12-4-3-7-19-12)20-14(17)9-11(15)8-13(16)18-2/h3-7,9-10H,8H2,1-2H3/b6-5+,11-9+
InChIKey APSHFPSXASBJQC-ZMLXFWSASA-N
Mol Weight 298.72 g/mol
Molecular Formula C14H15ClO5
Exact Mass 298.060801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BaUIkPou8bV
Name 2-Pentenedioic acid, 3-chloro-, 1-[3-(2-furanyl)-1-methyl-2-propenyl]5-methyl ester, (E,E)-
CAS Registry Number 97602-90-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15ClO5
InChI InChI=1S/C14H15ClO5/c1-10(5-6-12-4-3-7-19-12)20-14(17)9-11(15)8-13(16)18-2/h3-7,9-10H,8H2,1-2H3/b6-5+,11-9+
InChIKey APSHFPSXASBJQC-ZMLXFWSASA-N
Molecular Weight 298.722 g/mol
SMILES C(\C=C/(CC(=O)OC)Cl)(OC(\C=C\c1occc1)C)=O
SPLASH splash10-03ki-0900000000-c613bebe900bb6b10ac2
Source of Spectrum KC-1985-754-22
Synonyms 1-[(2E)-3-(2-furyl)-1-methyl-2-propenyl]5-methyl (2E)-3-chloro-2-pentenedioate 4-(2-Furyl)but-3-en-2-yl-3-chloro-4-methoxycarbonylbut-2-enoate
Wiley ID 1300638