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2-Hexenedioic acid, 5-fluoro-, 6-ethyl 1-methyl ester, (E)-
SpectraBase Compound ID B4NRIiGauvg
InChI InChI=1S/C9H13FO4/c1-3-14-9(12)7(10)5-4-6-8(11)13-2/h4,6-7H,3,5H2,1-2H3/b6-4+
InChIKey JIBPMOMNYRFIOU-GQCTYLIASA-N
Mol Weight 204.2 g/mol
Molecular Formula C9H13FO4
Exact Mass 204.079787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1q2xyFGQLFo
Name 2-Hexenedioic acid, 5-fluoro-, 6-ethyl 1-methyl ester, (E)-
CAS Registry Number 125950-63-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13FO4
InChI InChI=1S/C9H13FO4/c1-3-14-9(12)7(10)5-4-6-8(11)13-2/h4,6-7H,3,5H2,1-2H3/b6-4+
InChIKey JIBPMOMNYRFIOU-GQCTYLIASA-N
Molecular Weight 204.197 g/mol
SMILES C(=O)(C(F)C\C=C\C(=O)OC)OCC
SPLASH splash10-006t-9800000000-3244c105bfcbdc6b458d
Source of Spectrum J-55-2316-9
Synonyms 6-Ethyl 1-methyl (2E)-5-fluoro-2-hexenedioate Ethyl 2-fluoro-5-(methoxycarbonyl)-4-pentenoate
Wiley ID 1201366