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iso-Isopulegol
SpectraBase Compound ID IJOODL1XLvJ
InChI InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9-,10+/m1/s1
InChIKey ZYTMANIQRDEHIO-BBBLOLIVSA-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 BPdNkXDleAs
Name iso-Isopulegol
CAS Registry Number 59905-54-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9-,10+/m1/s1
InChIKey ZYTMANIQRDEHIO-BBBLOLIVSA-N
Molecular Weight 154.253 g/mol
SMILES O[C@@]1([C@](CC[C@](C1)(C)[H])(C(=C)C)[H])[H]
SPLASH splash10-01bc-9200000000-d88f957e0611c4037e8c
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Isopulegol
Wiley ID 1886542