[2H5]-ethyl 3-methylbutanoate

SpectraBase Compound ID	iXqZsUOipy
InChI	InChI=1S/C7H14O2/c1-4-9-7(8)5-6(2)3/h6H,4-5H2,1-3H3/i1D3,4D2
InChIKey	PPXUHEORWJQRHJ-SGEUAGPISA-N Google Search
Mol Weight	135.22 g/mol
Molecular Formula	C7H9D5O2
Exact Mass	135.130763 g/mol

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SpectraBase Spectrum ID	qaaQN3Tx3Y
Name	[2H5]-ethyl 3-methylbutanoate
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	135.130763418 u
Formula	C7H9D5O2
InChI	InChI=1S/C7H14O2/c1-4-9-7(8)5-6(2)3/h6H,4-5H2,1-3H3/i1D3,4D2
InChIKey	PPXUHEORWJQRHJ-SGEUAGPISA-N
Instrument Name	Agilent Technologies 6890N-5973N
Ionization Type	EI
Literature Reference DOI	10.1016/j.fochx.2019.100038
Molecular Weight	135.218 g/mol
Number of Peaks	17
SMILES	C([D])([D])(C([D])([D])[D])OC(CC(C)C)=O
SPLASH	splash10-0006-9000000000-f54d13b647aadca331bd
Source of Spectrum	FCX-3-3-[2H5]-ethyl 3-methylbutanoate (DOI: 10.1016/j.fochx.2019.100038)
Wiley ID	1857443