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3-methylene-4-phenyl-pent-4-enal
SpectraBase Compound ID 40vkykCp04D
InChI InChI=1S/C12H12O/c1-10(8-9-13)11(2)12-6-4-3-5-7-12/h3-7,9H,1-2,8H2
InChIKey GDKJQWDHRIEUNY-UHFFFAOYSA-N
Mol Weight 172.23 g/mol
Molecular Formula C12H12O
Exact Mass 172.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FjyhmwyW0
Name 3-methylene-4-phenyl-pent-4-enal
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.088815005 u
Formula C12H12O
InChI InChI=1S/C12H12O/c1-10(8-9-13)11(2)12-6-4-3-5-7-12/h3-7,9H,1-2,8H2
InChIKey GDKJQWDHRIEUNY-UHFFFAOYSA-N
Instrument Name Agilent HP 6890 series
Ionization Type EI
Literature Reference DOI 10.1002/anie.201510925
Molecular Weight 172.227 g/mol
Quality 73
Reported Formula C12H12O
SMILES C(CC=O)(C(C1=CC=CC=C1)=C)=C
SPLASH splash10-002f-0900000000-533af481ed38ad6ebc67
Source of Spectrum ACI-55-SM8-1c (DOI: 10.1002/anie.201510925)
Wiley ID 1895395