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Pent-4-ynoic Acid 2-Isopropyl-5-methylcyclohexyl Ester
SpectraBase Compound ID 2SvWtHOWytR
InChI InChI=1S/C15H24O2/c1-5-6-7-15(16)17-14-10-12(4)8-9-13(14)11(2)3/h1,11-14H,6-10H2,2-4H3
InChIKey DCZIVHDNYXJVMI-UHFFFAOYSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DL3W5G8UHG6
Name Pent-4-ynoic Acid 2-Isopropyl-5-methylcyclohexyl Ester
Alternate Name(s) 2-Isopropyl-5-methylcyclohexyl pent-4-ynoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-5-6-7-15(16)17-14-10-12(4)8-9-13(14)11(2)3/h1,11-14H,6-10H2,2-4H3
InChIKey DCZIVHDNYXJVMI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200303201
Molecular Weight 236.355 g/mol
SMILES C(CCC#C)(=O)OC1C(CCC(C1)C)C(C)C
SPLASH splash10-000i-3490000000-277cf3c7b7bfd3feb84c
Source of Spectrum ASC-346-436-2e
Wiley ID 1767564