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4-(4-Fluorophenyl)-2-methylpenta-2,3-diene
SpectraBase Compound ID B0D1BbANcf9
InChI InChI=1S/C12H13F/c1-9(2)8-10(3)11-4-6-12(13)7-5-11/h4-7H,1-3H3
InChIKey ROQMIAKWDSYXRA-UHFFFAOYSA-N
Mol Weight 176.23 g/mol
Molecular Formula C12H13F
Exact Mass 176.100129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HoWiUqS2aRs
Name 4-(4-Fluorophenyl)-2-methylpenta-2,3-diene
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 176.100128582 u
Formula C12H13F
InChI InChI=1S/C12H13F/c1-9(2)8-10(3)11-4-6-12(13)7-5-11/h4-7H,1-3H3
InChIKey ROQMIAKWDSYXRA-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202201211
Molecular Weight 176.234 g/mol
Quality 11
Reported Formula C12H13F
SMILES C1(F)=CC=C(C=C1)C(=C=C(C)C)C
SPLASH splash10-00di-2900000000-f2e61dfff204a12c06d3
Source of Spectrum ASC-365-SM33-2u (DOI: 10.1002/adsc.202201211)
Wiley ID 1902735