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1-(Butylthio)-2-butylcyclotridecene
SpectraBase Compound ID 8B7Ws4ahpwC
InChI InChI=1S/C21H40S/c1-3-5-16-20-17-14-12-10-8-7-9-11-13-15-18-21(20)22-19-6-4-2/h3-19H2,1-2H3/b21-20+
InChIKey BKOGDGYKQYZEGQ-QZQOTICOSA-N
Mol Weight 324.6 g/mol
Molecular Formula C21H40S
Exact Mass 324.285072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDrZhy8Busy
Name 1-(Butylthio)-2-butylcyclotridecene
Alternate Name(s) 1-Butyl-2-(butylsulfanyl)-1-cyclotridecene Butyl 2-butyl-1-cyclotridecen-1-yl sulfide
CAS Registry Number 73397-81-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40S
InChI InChI=1S/C21H40S/c1-3-5-16-20-17-14-12-10-8-7-9-11-13-15-18-21(20)22-19-6-4-2/h3-19H2,1-2H3/b21-20+
InChIKey BKOGDGYKQYZEGQ-QZQOTICOSA-N
Molecular Weight 324.611 g/mol
SMILES C(\C1=C\(CCCCCCCCCCC1)SCCCC)CCC
SPLASH splash10-066u-9031000000-f9093d072e07d979d321
Source of Spectrum J-45-2468-0
Wiley ID 1323669