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(-)-NEO-ISOPULEGOL
SpectraBase Compound ID EKXFhbH5yaH
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+/m0/s1
InChIKey ZYTMANIQRDEHIO-IVZWLZJFSA-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 yGwznCFuhq
Name Isopulegol
CAS Registry Number 121468-66-4
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+/m0/s1
InChIKey ZYTMANIQRDEHIO-IVZWLZJFSA-N
Molecular Weight 154.253 g/mol
SMILES O[C@]1([C@](CC[C@@](C1)(C)[H])(C(=C)C)[H])[H]
SPLASH splash10-00r6-9200000000-e72b5187885fd528c36f
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886541