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Cyclohexanepropionic acid allyl ester
SpectraBase Compound ID 58d3WivekrO
InChI InChI=1S/C12H20O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h2,11H,1,3-10H2
InChIKey TWXUTZNBHUWMKJ-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3aP20paqANn
Name Allyl cyclohexyl propanoate
CAS Registry Number 2705-87-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
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/C12H20O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h2,11H,1,3-10H2
InChIKey TWXUTZNBHUWMKJ-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C(CC1CCCCC1)C(OCC=C)=O
SPLASH splash10-052g-9200000000-d40427db90b39cf17662
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887187