For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-ISOPROPYL-5-METHYL-1-HEXANOL, ACETATE
SpectraBase Compound ID 4yCWrLhPNeB
InChI InChI=1S/C12H24O2/c1-9(2)6-7-12(10(3)4)8-14-11(5)13/h9-10,12H,6-8H2,1-5H3
InChIKey QLFSGYMLVZGFJT-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 14F6ldQqnvm
Name Lavandulyl acetate
CAS Registry Number 40853-55-2
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 200.177630011 u
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-9(2)6-7-12(10(3)4)8-14-11(5)13/h9-10,12H,6-8H2,1-5H3
InChIKey QLFSGYMLVZGFJT-UHFFFAOYSA-N
Molecular Weight 200.322 g/mol
Number of Peaks 48
RI1 1272
SMILES C(=O)(OCC(C(C)C)CCC(C)C)C
SPLASH splash10-052f-9000000000-34d80ff17e9bc7f4cf7a
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 1-Hexanol, 5-methyl-2-(1-methylethyl)-, 1-acetate
Wiley ID LM_FFNSC3_2882