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3-Methyl-2-butenal
SpectraBase Compound ID HUOPPh0A3ZB
InChI InChI=1S/C5H8O/c1-5(2)3-4-6/h3-4H,1-2H3
InChIKey SEPQTYODOKLVSB-UHFFFAOYSA-N
Mol Weight 84.12 g/mol
Molecular Formula C5H8O
Exact Mass 84.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JlF55jnkeig
Name 3-Methyl-2-butenal
CAS Registry Number 107-86-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C5H8O/c1-5(2)3-4-6/h3-4H,1-2H3
InChIKey SEPQTYODOKLVSB-UHFFFAOYSA-N
Molecular Weight 84.118 g/mol
SMILES C(=C(C)C)C=O
SPLASH splash10-0kal-9000000000-ecb895bfd6a65ebd953b
Source ex ALDRICH
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Methyl-2-butenal<3->
Wiley ID 1887619