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2-(3-Isopropylpent-4-ynyl)-cyclohexanone

View entire compound with spectra: 1 MS (GC)

2-(3-Isopropylpent-4-ynyl)-cyclohexanone
SpectraBase Compound ID 9B4HvyHftUC
InChI InChI=1S/C14H22O/c1-4-12(11(2)3)9-10-13-7-5-6-8-14(13)15/h1,11-13H,5-10H2,2-3H3
InChIKey OHHGTIRYQACUFA-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbIGQeWe0bY
Name 2-(3-Isopropylpent-4-ynyl)-cyclohexanone
Alternate Name(s) 2-(3-isopropylpent-4-yn-1-yl)cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-4-12(11(2)3)9-10-13-7-5-6-8-14(13)15/h1,11-13H,5-10H2,2-3H3
InChIKey OHHGTIRYQACUFA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200505211
Molecular Weight 206.329 g/mol
SMILES C1(C(CCCC1)CCC(C#C)C(C)C)=O
SPLASH splash10-0005-9100000000-38068ab6dad726378d0c
Source of Spectrum ASC-347-1587/SM23-14c
Wiley ID 1767736