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2-Butenal, 2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
SpectraBase Compound ID JrK5lWE9rEz
InChI InChI=1S/C14H22O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h7,10H,5-6,8-9H2,1-4H3/b11-7+
InChIKey FJCQUJKUMKZEMH-YRNVUSSQSA-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 6NGnFtSoPzk
Name But-2-enal <2-methyl-, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)->
CAS Registry Number 3155-71-3
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 206.167065327 u
Formula C14H22O
InChI InChI=1S/C14H22O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h7,10H,5-6,8-9H2,1-4H3/b11-7+
InChIKey FJCQUJKUMKZEMH-YRNVUSSQSA-N
Molecular Weight 206.329 g/mol
Number of Peaks 50
RI1 1581
RI2 1259
SMILES C1CC(=C(C(C1)(C)C)C\C=C\(C=O)C)C
SPLASH splash10-0abc-9800000000-d7f66d1770424d4c35a0
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Butenal, 2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
Wiley ID LM_FFNSC3_1159