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2,2-Dimethyl-3,4-octadienal
SpectraBase Compound ID 20Q1qEOyskg
InChI InChI=1S/C10H16O/c1-4-5-6-7-8-10(2,3)9-11/h6,8-9H,4-5H2,1-3H3
InChIKey VSFHYKIILWBKOH-UHFFFAOYSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENX9SUiO7VU
Name Octadienal <2,2-dimethyl-3,4->
CAS Registry Number 590-71-6
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 152.120115134 u
Formula C10H16O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C10H16O/c1-4-5-6-7-8-10(2,3)9-11/h6,8-9H,4-5H2,1-3H3
InChIKey VSFHYKIILWBKOH-UHFFFAOYSA-N
Molecular Weight 152.237 g/mol
Nominal Mass 152 u
Number of Peaks 82
SMILES CC(C=C=CCCC)(C)C=O
SPLASH splash10-006x-9100000000-d2fb79bf74f5053d875d
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001962