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ESSIGSAEURE-1-METHYL-PENTYLESTER
SpectraBase Compound ID JGZRnHN09cs
InChI InChI=1S/C8H16O2/c1-4-5-6-7(2)10-8(3)9/h7H,4-6H2,1-3H3
InChIKey RXTNIJMLAQNTEG-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxPJPT0Pchn
Name 2-Acetoxyhexane
CAS Registry Number 5953-49-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O2
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/C8H16O2/c1-4-5-6-7(2)10-8(3)9/h7H,4-6H2,1-3H3
InChIKey RXTNIJMLAQNTEG-UHFFFAOYSA-N
Molecular Weight 144.214 g/mol
SMILES C(OC(C)=O)(CCCC)C
SPLASH splash10-0006-9000000000-1e21ba491eb6cea18f32
Source ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Acetoxyhexane<2->
Wiley ID 1887180