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Isopentyl 8-methylnon-6-enoate

View entire compound with spectra: 1 NMR, and 1 FTIR

Isopentyl 8-methylnon-6-enoate
SpectraBase Compound ID DRjixHriq9W
InChI InChI=1S/C15H28O2/c1-13(2)9-7-5-6-8-10-15(16)17-12-11-14(3)4/h7,9,13-14H,5-6,8,10-12H2,1-4H3/b9-7+
InChIKey YWFMHFBFSKQAMK-VQHVLOKHSA-N
Mol Weight 240.39 g/mol
Molecular Formula C15H28O2
Exact Mass 240.20893 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DrlSBDtdUDO
Name Isopentyl 8-methylnon-6-enoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.208930140 u
Formula C15H28O2
InChI InChI=1S/C15H28O2/c1-13(2)9-7-5-6-8-10-15(16)17-12-11-14(3)4/h7,9,13-14H,5-6,8,10-12H2,1-4H3/b9-7+
InChIKey YWFMHFBFSKQAMK-VQHVLOKHSA-N
Molecular Weight 240.387 g/mol
SMILES C(CCCC\C=C\C(C)C)(=O)OCCC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.984794