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4-methylvaleric acid, ethyl ester

View entire compound with spectra: 2 NMR, 2 FTIR, and 4 MS (GC)

4-methylvaleric acid, ethyl ester
SpectraBase Compound ID BBQTj2hCVRD
InChI InChI=1S/C8H16O2/c1-4-10-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3
InChIKey OFQRUTMGVBMTFQ-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID CE94LQupP24
Name 4-METHYLVALERIC ACID, ETHYL ESTER
Source of Sample Fluka Chemie AG, Buchs, Switzerland
Boiling Point 152C
CAS Registry Number 25415-67-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Density (20/4C) 0.871
Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-4-10-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3
InChIKey OFQRUTMGVBMTFQ-UHFFFAOYSA-N
Molecular Weight 144.214005
Optical Properties Index of Refraction= (20C) 1.405
Synonyms VALERIC ACID, 4-METHYL-, ETHYL ESTER
Technique CAPILLARY CELL: NEAT