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(-)-Menthyl p-(2-Bromoethyl)benzenesulfinate
SpectraBase Compound ID IsGfKo5aPyq
InChI InChI=1S/C18H27BrO2S/c1-13(2)17-9-4-14(3)12-18(17)21-22(20)16-7-5-15(6-8-16)10-11-19/h5-8,13-14,17-18H,4,9-12H2,1-3H3
InChIKey MIWIOBFZBXEJAU-UHFFFAOYSA-N
Mol Weight 387.38 g/mol
Molecular Formula C18H27BrO2S
Exact Mass 386.091514 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9Ox56GWXOU
Name (-)-Menthyl p-(2-Bromoethyl)benzenesulfinate
Alternate Name(s) 2-isopropyl-5-methylcyclohexyl 4-(2-bromoethyl)benzenesulfinate
CAS Registry Number 113344-69-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H27BrO2S
InChI InChI=1S/C18H27BrO2S/c1-13(2)17-9-4-14(3)12-18(17)21-22(20)16-7-5-15(6-8-16)10-11-19/h5-8,13-14,17-18H,4,9-12H2,1-3H3
InChIKey MIWIOBFZBXEJAU-UHFFFAOYSA-N
Molecular Weight 387.376 g/mol
SMILES C1(OS(c2ccc(cc2)CCBr)=O)C(CCC(C1)C)C(C)C
SPLASH splash10-001r-9400000000-2535f13560891b192a52
Source of Spectrum B-40-72-13
Wiley ID 1362472