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Menthyl acetate<iso->
SpectraBase Compound ID DQK7O78fAa0
InChI InChI=1S/C12H22O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11+,12-/m0/s1
InChIKey JAKFDYGDDRCJLY-WCQGTBRESA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJPVPHz5URz
Name Menthyl acetate
CAS Registry Number 20777-45-1
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 198.161979946 u
Formula C12H22O2
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/C12H22O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11+,12-/m0/s1
InChIKey JAKFDYGDDRCJLY-WCQGTBRESA-N
Nominal Mass 198 u
Number of Peaks 91
SMILES CC(C)[C@@]1(CC[C@@]([C@](C1)(OC(C)=O)[H])(C)[H])[H]
SPLASH splash10-0007-9100000000-3d2361d512b9de7538ac
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000916