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1-Chloro-4-(oct-2-ynyl)benzene
SpectraBase Compound ID CIcbQ8XCdOF
InChI InChI=1S/C14H17Cl/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h9-12H,2-5,8H2,1H3
InChIKey ZZMCYQBJZOBCCY-UHFFFAOYSA-N
Mol Weight 220.74 g/mol
Molecular Formula C14H17Cl
Exact Mass 220.101878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrTsAKYDoj8
Name 1-Chloro-4-(oct-2-ynyl)benzene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17Cl
InChI InChI=1S/C14H17Cl/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h9-12H,2-5,8H2,1H3
InChIKey ZZMCYQBJZOBCCY-UHFFFAOYSA-N
Molecular Weight 220.743 g/mol
SMILES c1(Cl)ccc(cc1)CC#CCCCCC
SPLASH splash10-004i-0920000000-a0d1c8c8bb485317f167
Source of Spectrum J-75-5263-18
Synonyms 1-Chloro-4-(oct-2-yn-1-yl)benzene
Wiley ID 1746639