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Heptanoic acid, butyl ester
SpectraBase Compound ID EhOnhkJ4iBp
InChI InChI=1S/C11H22O2/c1-3-5-7-8-9-11(12)13-10-6-4-2/h3-10H2,1-2H3
InChIKey YPQSPODHFDGVAC-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AbF5Qa5U2LL
Name BUTYL HEPTANOATE
Source of Sample M. Dymicky, USDA, Eastern Regional Research Center, Philadelphia, Pennsylvania
Boiling Point 226.2C
CAS Registry Number 5454-28-4
Compound Type Pure
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Density 0.8638 (20/4C)
FEMA Number 2199
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-3-5-7-8-9-11(12)13-10-6-4-2/h3-10H2,1-2H3
InChIKey YPQSPODHFDGVAC-UHFFFAOYSA-N
Melting Point -67.5C
Molecular Weight 186.30
Synonyms BUTYL HEPTOATE BUTYL HEPTYLATE HEPTANOIC ACID, BUTYL ESTER
Technique CAPILLARY CELL: NEAT