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Terpinyl formate, mixture of isomers
SpectraBase Compound ID 4RxKYpN8aJC
InChI InChI=1S/C11H18O2/c1-9-4-6-10(7-5-9)11(2,3)13-8-12/h4,8,10H,5-7H2,1-3H3
InChIKey IPYLQIQMGUZFCK-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BT7DwyNqOsk
Name Terpinyl formate
Source of Sample SAFC Cat.no. W305200
CAS Registry Number 2153-26-6
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 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-9-4-6-10(7-5-9)11(2,3)13-8-12/h4,8,10H,5-7H2,1-3H3
InChIKey IPYLQIQMGUZFCK-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
Number of Peaks 50
RI1 1306
RI2 984
RI3 1117
RI4 1076
SMILES C1=C(CCC(C1)C(C)(C)OC=O)C
SPLASH splash10-006x-9400000000-61289870d4347d02dd4a
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,alpha,alpha,4-trimethyl-, formate
Wiley ID LM_FFNSC3_273