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1-Butyl-3-chlorobenzene
SpectraBase Compound ID HM1HDdKCwPW
InChI InChI=1S/C10H13Cl/c1-2-3-5-9-6-4-7-10(11)8-9/h4,6-8H,2-3,5H2,1H3
InChIKey VQSDBQDNUIWPKK-UHFFFAOYSA-N
Mol Weight 168.67 g/mol
Molecular Formula C10H13Cl
Exact Mass 168.070578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CAmeKVVmd6n
Name 1-Butyl-3-chlorobenzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13Cl
InChI InChI=1S/C10H13Cl/c1-2-3-5-9-6-4-7-10(11)8-9/h4,6-8H,2-3,5H2,1H3
InChIKey VQSDBQDNUIWPKK-UHFFFAOYSA-N
Instrument Name HP 5995C
Ionization Type EI
Literature Reference DOI 10.1002/anie.202101571
Molecular Weight 168.667 g/mol
Reported Formula C10H13Cl
SMILES c1ccc(cc1Cl)CCCC
SPLASH splash10-004i-4900000000-ab30bcd1de41592e3e35
Source of Spectrum ACI-60-SM10-8
Wiley ID 1880371