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3,7-Dimethyloctanal
SpectraBase Compound ID H1ZWq4o3ZiM
InChI InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h8-10H,4-7H2,1-3H3
InChIKey UCSIFMPORANABL-UHFFFAOYSA-N
Mol Weight 156.27 g/mol
Molecular Formula C10H20O
Exact Mass 156.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BpZOwiQt773
Name Dihydrocitronellal
CAS Registry Number 5988-91-0
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 156.151415263 u
Formula C10H20O
InChI InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h8-10H,4-7H2,1-3H3
InChIKey UCSIFMPORANABL-UHFFFAOYSA-N
Molecular Weight 156.269 g/mol
Number of Peaks 50
RI1 1125
RI2 802
RI3 792
RI4 744
RI5 1106
SMILES CC(CC=O)CCCC(C)C
SPLASH splash10-0a4l-9000000000-15b007515d484e6acc33
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 3,7-dimethyl octanal
Wiley ID LM_FFNSC3_3165