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1-Methyl-3-(4-methylpent-3-enyl)cyclohex-3-enecarboxaldehyde
SpectraBase Compound ID CXSMAgaotiS
InChI InChI=1S/C14H22O/c1-12(2)5-4-6-13-7-9-14(3,11-15)10-8-13/h5,7,11H,4,6,8-10H2,1-3H3
InChIKey VUIWFNRBSGUSIN-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 E1zDKA6O8ou
Name 1-Methyl-4-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxaldehyde
CAS Registry Number 52475-86-2
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/c1-12(2)5-4-6-13-7-9-14(3,11-15)10-8-13/h5,7,11H,4,6,8-10H2,1-3H3
InChIKey VUIWFNRBSGUSIN-UHFFFAOYSA-N
Molecular Weight 206.329 g/mol
Number of Peaks 50
RI1 1532
RI2 1208
RI3 1319
RI4 1278
SMILES C1(CC=C(CC1)CCC=C(C)C)(C=O)C
SPLASH splash10-00kf-9300000000-654f4d8ba56f63c6a8c1
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 3-Cyclohexene-1-carboxaldehyde, 1-methyl-4-(4-methyl-3-penten-1-yl)-
Wiley ID LM_FFNSC3_1316