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2-(1,4,4-Trimethylcyclohex-2-en-1-yl)ethyl p-toluenesulfonate
SpectraBase Compound ID 2dPRjQ0vdzG
InChI InChI=1S/C18H26O3S/c1-15-5-7-16(8-6-15)22(19,20)21-14-13-18(4)11-9-17(2,3)10-12-18/h5-9,11H,10,12-14H2,1-4H3
InChIKey QPQSTFANPCKWRP-UHFFFAOYSA-N
Mol Weight 322.46 g/mol
Molecular Formula C18H26O3S
Exact Mass 322.160266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hEXHYXQpeC
Name 2-(1,4,4-Trimethylcyclohex-2-en-1-yl)ethyl p-toluenesulfonate
Alternate Name(s) 2-(1,4,4-Trimethyl-2-cyclohexen-1-yl)ethyl 4-methylbenzenesulfonate 2-(1,4,4-trimethylcyclohex-2-en-1-yl)ethyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid 2-(1,4,4-trimethyl-1-cyclohex-2-enyl)ethyl ester 4-Methylbenzenesulfonic acid 2-(1,4,4-trimethylcyclohex-2-en-1-yl)ethyl ester
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Formula C18H26O3S
InChI InChI=1S/C18H26O3S/c1-15-5-7-16(8-6-15)22(19,20)21-14-13-18(4)11-9-17(2,3)10-12-18/h5-9,11H,10,12-14H2,1-4H3
InChIKey QPQSTFANPCKWRP-UHFFFAOYSA-N
Molecular Weight 322.463 g/mol
SMILES C1(CCC(C=C1)(CCOS(=O)(=O)c1ccc(cc1)C)C)(C)C
SPLASH splash10-00di-6900000000-f049b66763d00c8b7fac
Wiley ID 1479526