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2-(2,3,4,5,6-pentafluorobenzyl)hept-6-enoic acid methyl ester
SpectraBase Compound ID AwrwyRGowpu
InChI InChI=1S/C15H15F5O2/c1-3-4-5-6-8(15(21)22-2)7-9-10(16)12(18)14(20)13(19)11(9)17/h3,8H,1,4-7H2,2H3/t8-/m1/s1
InChIKey PZYMBMYWUNGAAN-MRVPVSSYSA-N
Mol Weight 322.28 g/mol
Molecular Formula C15H15F5O2
Exact Mass 322.099221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBCha69bkKS
Name 2-(2,3,4,5,6-pentafluorobenzyl)hept-6-enoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15F5O2
InChI InChI=1S/C15H15F5O2/c1-3-4-5-6-8(15(21)22-2)7-9-10(16)12(18)14(20)13(19)11(9)17/h3,8H,1,4-7H2,2H3/t8-/m1/s1
InChIKey PZYMBMYWUNGAAN-MRVPVSSYSA-N
Molecular Weight 322.275 g/mol
SMILES c1(c(c(F)c(c(c1F)F)F)F)C[C@](C(=O)OC)(CCCC=C)[H]
SPLASH splash10-000x-3930000000-89a5261eb71851217a64
Source of Spectrum F-54-13862-22
Synonyms 2-[(2,3,4,5,6-pentafluorophenyl)methyl]-6-heptenoic acid methyl ester Methyl 2-[(2,3,4,5,6-pentafluorophenyl)methyl]hept-6-enoate Methyl 2-[[2,3,4,5,6-pentakis(fluoranyl)phenyl]methyl]hept-6-enoate
Wiley ID 809531