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3-Butenoic acid pentafluorobenzyl ester
SpectraBase Compound ID ISKIRWcdZeM
InChI InChI=1S/C11H7F5O2/c1-2-3-6(17)18-4-5-7(12)9(14)11(16)10(15)8(5)13/h2H,1,3-4H2
InChIKey XWYRGTXWYMMIGE-UHFFFAOYSA-N
Mol Weight 266.17 g/mol
Molecular Formula C11H7F5O2
Exact Mass 266.03662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ITpHGmqxjE
Name 3-Butenoic acid pentafluorobenzyl ester
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 266.036620278 u
Formula C11H7F5O2
InChI InChI=1S/C11H7F5O2/c1-2-3-6(17)18-4-5-7(12)9(14)11(16)10(15)8(5)13/h2H,1,3-4H2
InChIKey XWYRGTXWYMMIGE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 266.167 g/mol
Nominal Mass 266 u
Quality 819
Retention Index 1506
SMILES C=1(C(=C(C(=C(C1F)F)F)F)F)COC(CC=C)=O
SPLASH splash10-001i-1900000000-0cda7ec5860dfaea4d74
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2,3,4,5,6-pentafluorobenzyl but-3-enoate
Technique GC/MS
Wiley ID DD2024_008856