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3-(4-isobutyl-6-methylcyclohexa-1,5-dien-1-yl)propanal
SpectraBase Compound ID CwmII9QocB2
InChI InChI=1S/C14H22O/c1-11(2)9-13-6-7-14(5-4-8-15)12(3)10-13/h7-8,10-11,13H,4-6,9H2,1-3H3
InChIKey CEHVGEOJHWDCSN-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jx2DNJJ2Uqf
Name 3-(4-isobutyl-6-methylcyclohexa-1,5-dien-1-yl)propanal
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.167065327 u
Formula C14H22O
GC Column ZB-1 (20 m x0.18 mm, film thickness 0.18 micrometer)
InChI InChI=1S/C14H22O/c1-11(2)9-13-6-7-14(5-4-8-15)12(3)10-13/h7-8,10-11,13H,4-6,9H2,1-3H3
InChIKey CEHVGEOJHWDCSN-UHFFFAOYSA-N
Instrument Name Shimadzu QP 2010
Ionization Type EI
Literature Reference DOI 10.1002/hlca.202300040
Molecular Weight 206.329 g/mol
Quality 190
Reported Formula C14H22O
SMILES C(C(C)C)C1CC=C(C(=C1)C)CCC=O
SPLASH splash10-0a4i-1900000000-0e48dbb1a8ccee6d424d
Source of Spectrum H-106-11-28b (DOI: 10.1002/hlca.202300040)
Wiley ID 1911477