[2H5]-ethyl heptanoate

SpectraBase Compound ID	Evj9bWKu37N
InChI	InChI=1S/C9H18O2/c1-3-5-6-7-8-9(10)11-4-2/h3-8H2,1-2H3/i2D3,4D2
InChIKey	TVQGDYNRXLTQAP-PVGOWFQYSA-N Google Search
Mol Weight	163.27 g/mol
Molecular Formula	C9H13D5O2
Exact Mass	163.162064 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	A4C9picHK9F
Name	[2H5]-ethyl heptanoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C9H13D5O2
InChI	InChI=1S/C9H18O2/c1-3-5-6-7-8-9(10)11-4-2/h3-8H2,1-2H3/i2D3,4D2
InChIKey	TVQGDYNRXLTQAP-PVGOWFQYSA-N
Instrument Name	Agilent Technologies 6890N-5973N
Ionization Type	EI
Literature Reference DOI	10.1016/j.fochx.2019.100038
Molecular Weight	163.272 g/mol
SMILES	C([D])([D])(C([D])([D])[D])OC(CCCCCC)=O
SPLASH	splash10-0006-9200000000-a9000433a8fa843f03a3
Source of Spectrum	FCX-3-3-[2H5]-ethyl heptanoate
Wiley ID	1857448