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4-Ethyloctanoic acid

View entire compound with spectra: 1 NMR, 3 FTIR, 1 Raman, and 2 MS (GC)

4-Ethyloctanoic acid
SpectraBase Compound ID FdKPZ0vDlFG
InChI InChI=1S/C10H20O2/c1-3-5-6-9(4-2)7-8-10(11)12/h9H,3-8H2,1-2H3,(H,11,12)
InChIKey PWKJMPFEQOHBAC-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 1UEI4FcxGCI
Name 4-Ethyloctanoic acid
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number B22220
Lot Number 10179238
CAS Registry Number 16493-80-4
Classification Flavors and Fragrances
Copyright Copyright © 2016-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-3-5-6-9(4-2)7-8-10(11)12/h9H,3-8H2,1-2H3,(H,11,12)
InChIKey PWKJMPFEQOHBAC-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Purity 97%
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Synonyms 4-Ethylcaprylic acid
Technique ATR-Neat (DuraSamplIR II)