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[(E)-7-chloranylhept-3-en-1-ynyl]benzene
SpectraBase Compound ID BdighocarOE
InChI InChI=1S/C13H13Cl/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h1-2,4,6-7,10-11H,3,8,12H2/b2-1+
InChIKey QDGCUZSNGXGDOH-OWOJBTEDSA-N
Mol Weight 204.7 g/mol
Molecular Formula C13H13Cl
Exact Mass 204.070578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIRhRsrCJOX
Name [(E)-7-chloranylhept-3-en-1-ynyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13Cl
InChI InChI=1S/C13H13Cl/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h1-2,4,6-7,10-11H,3,8,12H2/b2-1+
InChIKey QDGCUZSNGXGDOH-OWOJBTEDSA-N
Literature Reference DOI 10.1002/cjoc.20030210424
Molecular Weight 204.700 g/mol
SMILES C(#C\C=C\CCCCl)c1ccccc1
SPLASH splash10-05mo-0920000000-aba8419722c03aa04acd
Source of Spectrum CJC-21-476-476_9
Synonyms 7-Chloro-1-phenyl-3-hepten-1-yne [(E)-7-chlorohept-3-en-1-ynyl]benzene (E)-(7-chlorohept-3-en-1-yn-1-yl)benzene
Wiley ID 1773716