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(-)-Menthol 1,2-Diphenylethanesulfonate
SpectraBase Compound ID 22qZMaoreDf
InChI InChI=1S/C24H32O3S/c1-18(2)22-15-14-19(3)16-23(22)27-28(25,26)24(21-12-8-5-9-13-21)17-20-10-6-4-7-11-20/h4-13,18-19,22-24H,14-17H2,1-3H3/t19-,22+,23-,24?/m1/s1
InChIKey GFCZLJXODSPDFN-QDLHARERSA-N
Mol Weight 400.6 g/mol
Molecular Formula C24H32O3S
Exact Mass 400.207216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaUxZoJ3Vae
Name (-)-Menthol 1,2-Diphenylethanesulfonate
Alternate Name(s) (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 1,2-diphenylethanesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C24H32O3S
InChI InChI=1S/C24H32O3S/c1-18(2)22-15-14-19(3)16-23(22)27-28(25,26)24(21-12-8-5-9-13-21)17-20-10-6-4-7-11-20/h4-13,18-19,22-24H,14-17H2,1-3H3/t19-,22+,23-,24?/m1/s1
InChIKey GFCZLJXODSPDFN-QDLHARERSA-N
Molecular Weight 400.577 g/mol
SMILES [C@@]1(OS(C(Cc2ccccc2)c2ccccc2)(=O)=O)([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H]
SPLASH splash10-001i-0900000000-5268ebff276ded073428
Source of Spectrum KC-61-3238-10
Wiley ID 1628343