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3,7-dimethyl-7-hydroxyoctanal
SpectraBase Compound ID DdjyqA6Mymp
InChI InChI=1S/C10H20O2/c1-9(6-8-11)5-4-7-10(2,3)12/h8-9,12H,4-7H2,1-3H3
InChIKey WPFVBOQKRVRMJB-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Ylc0ac83MA
Name Hydroxy citronellal
CAS Registry Number 107-75-5
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 172.146329882 u
Formula C10H20O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C10H20O2/c1-9(6-8-11)5-4-7-10(2,3)12/h8-9,12H,4-7H2,1-3H3
InChIKey WPFVBOQKRVRMJB-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
Nominal Mass 172 u
Number of Peaks 111
SMILES OC(CCCC(CC=O)C)(C)C
SPLASH splash10-0a4l-9000000000-655e677f74076718ed7d
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001757