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Butyl levulinate

View entire compound with spectra: 5 NMR, 7 FTIR, 2 Raman, and 7 MS (GC)

Butyl levulinate
SpectraBase Compound ID G6sEjvfSU9N
InChI InChI=1S/C9H16O3/c1-3-4-7-12-9(11)6-5-8(2)10/h3-7H2,1-2H3
InChIKey ISBWNEKJSSLXOD-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID GOeH6wOLyxI
Name BUTYL LEVULINATE
Source of Sample The Quaker Oats Company, Chicago, Illinois
Boiling Point 106-108C/5.5 MM
CAS Registry Number 2052-15-5
Compound Type Pure
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Density 0.974
FEMA Number 2207
Flash Point 91C
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-3-4-7-12-9(11)6-5-8(2)10/h3-7H2,1-2H3
InChIKey ISBWNEKJSSLXOD-UHFFFAOYSA-N
Molecular Weight 172.23
Sample Description FRUITY
Synonyms BUTYL ACETYLPROPIONATE BUTYL 4-OXOPENTANOATE BUTYL 4-KETOVALERATE 4-OXOPENTANOIC ACID, BUTYL ESTER LEVULINIC ACID, BUTYL ESTER
Technique CAPILLARY CELL: NEAT