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Isocyclogeraniol
SpectraBase Compound ID 7fmoWz9efsm
InChI InChI=1S/C10H18O/c1-7-4-8(2)10(6-11)9(3)5-7/h4,8-11H,5-6H2,1-3H3
InChIKey DMXUBGVVJLVCPB-UHFFFAOYSA-N
Mol Weight 154.25 g/mol
Molecular Formula C10H18O
Exact Mass 154.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRiYRKRchsW
Name Isocyclogeraniol
CAS Registry Number 68527-77-5
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 154.135765199 u
Formula C10H18O
InChI InChI=1S/C10H18O/c1-7-4-8(2)10(6-11)9(3)5-7/h4,8-11H,5-6H2,1-3H3
InChIKey DMXUBGVVJLVCPB-UHFFFAOYSA-N
Molecular Weight 154.253 g/mol
Number of Peaks 50
RI1 1237
RI2 915
RI3 1213
RI4 1170
SMILES OCC1C(CC(=CC1C)C)C
SPLASH splash10-00ec-9500000000-c89a43354526452b4a81
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-methanol, 2,4,6-trimethyl-
Wiley ID LM_FFNSC3_1315