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2-Octenal, 2-butyl-

View entire compound with spectra: 1 FTIR, and 6 MS (GC)

2-Octenal, 2-butyl-
SpectraBase Compound ID Lqo1U5vqTSL
InChI InChI=1S/C12H22O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h10-11H,3-9H2,1-2H3/b12-10+
InChIKey LYGMPIZYNJGJKP-ZRDIBKRKSA-N
Mol Weight 182.31 g/mol
Molecular Formula C12H22O
Exact Mass 182.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2VvxElLxOo
Name 2-OCTENAL, 2-BUTYL-
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 182.167065327 u
Formula C12H22O
InChI InChI=1S/C12H22O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h10-11H,3-9H2,1-2H3/b12-10+
InChIKey LYGMPIZYNJGJKP-ZRDIBKRKSA-N
Molecular Weight 182.307 g/mol
Nominal Mass 182 u
Number of Peaks 103
SMILES CCCCC\C=C/(CCCC)C=O
SPLASH splash10-054o-9200000000-39cc57b19592cba12776
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX001146