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1-(2-Methylphenyl)hex-1-yne
SpectraBase Compound ID 8CWeEq4lJHN
InChI InChI=1S/C13H16/c1-3-4-5-6-10-13-11-8-7-9-12(13)2/h7-9,11H,3-5H2,1-2H3
InChIKey KSOSFFUHWOHFEE-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVeoB5LWEW6
Name 1-(2-Methylphenyl)hex-1-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-3-4-5-6-10-13-11-8-7-9-12(13)2/h7-9,11H,3-5H2,1-2H3
InChIKey KSOSFFUHWOHFEE-UHFFFAOYSA-N
Molecular Weight 172.271 g/mol
SMILES C(#CCCCC)c1c(C)cccc1
SPLASH splash10-004l-0900000000-da58f62042cec113fbda
Source of Spectrum F-66-7759-18
Wiley ID 1684526