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Benzene, (1-chloro-3,5-dimethyl-4-hexenyl)-, (R*,R*)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Benzene, (1-chloro-3,5-dimethyl-4-hexenyl)-, (R*,R*)-
SpectraBase Compound ID 7S2BkncdIjJ
InChI InChI=1S/C14H19Cl/c1-11(2)9-12(3)10-14(15)13-7-5-4-6-8-13/h4-9,12,14H,10H2,1-3H3
InChIKey QSYKYIPKHNKFRS-UHFFFAOYSA-N
Mol Weight 222.76 g/mol
Molecular Formula C14H19Cl
Exact Mass 222.117528 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1ZTuubxYLox
Name Benzene, (1-chloro-3,5-dimethyl-4-hexenyl)-, (R*,R*)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.117528312 u
Formula C14H19Cl
InChI InChI=1S/C14H19Cl/c1-11(2)9-12(3)10-14(15)13-7-5-4-6-8-13/h4-9,12,14H,10H2,1-3H3
InChIKey QSYKYIPKHNKFRS-UHFFFAOYSA-N
Molecular Weight 222.759 g/mol
SMILES C(=C(C)C)C(CC(C=1C=CC=CC1)Cl)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.965018