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2-(Hex-1-yn-1-yl)-1-methylcyclohex-2-ene-1-carbaldehyde
SpectraBase Compound ID K79yzasRlmp
InChI InChI=1S/C14H20O/c1-3-4-5-6-9-13-10-7-8-11-14(13,2)12-15/h10,12H,3-5,7-8,11H2,1-2H3
InChIKey UFAOZCUBRBVOLR-UHFFFAOYSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3X7z1TzclD0
Name 2-(Hex-1-yn-1-yl)-1-methylcyclohex-2-ene-1-carbaldehyde
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-3-4-5-6-9-13-10-7-8-11-14(13,2)12-15/h10,12H,3-5,7-8,11H2,1-2H3
InChIKey UFAOZCUBRBVOLR-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202203068
Molecular Weight 204.313 g/mol
Quality 21
Reported Formula C14H20O
SMILES C(#CCCCC)C=1C(CCCC1)(C)C=O
SPLASH splash10-03fr-0900000000-9b1c8afdece50fb19768
Source of Spectrum QE-29-SM16-9 (DOI: 10.1002/chem.202203068)
Thin-Layer Chromatography 0.61 (14% EtOAc/hexane)
Wiley ID 1909467