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Isoamyl isovalerate
SpectraBase Compound ID 9FoffEZIJy
InChI InChI=1S/C10H20O2/c1-8(2)5-6-12-10(11)7-9(3)4/h8-9H,5-7H2,1-4H3
InChIKey XINCECQTMHSORG-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Kn6fvbApugz
Name ISOPENTYL ISOVALERATE
Source of Sample Philadelphia College of Pharmacy & Science, Philadelphia, Pennsylvania
Boiling Point 190.4C
CAS Registry Number 659-70-1
Comments USED TO IMPART APPLE FLAVORING TO LIQUEURS AND CANDY. SLIGHTLY SOLUBLE IN WATER; MISCIBLE WITH ALCOHOL, ETHER. NIOSH= NY15080
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Density 20C=0.8700; 25C=0.8541 G/ML
Dielectric Constant 3.62 (19C)
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-8(2)5-6-12-10(11)7-9(3)4/h8-9H,5-7H2,1-4H3
InChIKey XINCECQTMHSORG-UHFFFAOYSA-N
Melting Point 172.27C
Molecular Weight 172.27
Optical Properties Index of Refraction= 18.7C=1.41300; 25C=1.4100
Synonyms 3-METHYL-1-BUTYL ISOVALERATE ISOAMYL ISOVALERATE 3-METHYLBUTYL-3-METHYLBUTANOATE ISOAMYL VALERIANATE APPLE OIL
Technique NEAT
Vapor Pressure 1 (27.0C) TORR