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1,3-Hexadiene, 4-chloro-2,3-dimethyl-, (E)-
SpectraBase Compound ID JI7hPqNedOb
InChI InChI=1S/C8H13Cl/c1-5-8(9)7(4)6(2)3/h2,5H2,1,3-4H3/b8-7+
InChIKey RIDCARBEKJXPKS-BQYQJAHWSA-N
Mol Weight 144.64 g/mol
Molecular Formula C8H13Cl
Exact Mass 144.070578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPGYJKL2plU
Name 1,3-Hexadiene, 4-chloro-2,3-dimethyl-, (E)-
CAS Registry Number 105949-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13Cl
InChI InChI=1S/C8H13Cl/c1-5-8(9)7(4)6(2)3/h2,5H2,1,3-4H3/b8-7+
InChIKey RIDCARBEKJXPKS-BQYQJAHWSA-N
Molecular Weight 144.645 g/mol
SMILES CC\C(Cl)=C\(C)C(C)=C
SPLASH splash10-052f-0900000000-17af29e7ce9fac155e5d
Source of Spectrum I-64-1556-5
Synonyms (3E)-4-Chloro-2,3-dimethyl-1,3-hexadiene (3E)-4-chloranyl-2,3-dimethyl-hexa-1,3-diene (3E)-4-chloro-2,3-dimethyl-hexa-1,3-diene (E)-4-Chloro-2,3-dimethyl-1,3-hexadiene
Wiley ID 1142575