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TMS-steviol methyl ester
SpectraBase Compound ID BTMjOappyCs
InChI InChI=1S/C24H40O3Si/c1-17-15-23-13-9-18-21(2,11-8-12-22(18,3)20(25)26-4)19(23)10-14-24(17,16-23)27-28(5,6)7/h18-19H,1,8-16H2,2-7H3/t18-,19-,21+,22-,23+,24-/m1/s1
InChIKey XXBLIPZIYGFRNX-UELWMSMESA-N
Mol Weight 404.7 g/mol
Molecular Formula C24H40O3Si
Exact Mass 404.274672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcsTSSc4DAM
Name TMS-steviol methyl ester
Alternate Name(s) methyl (4beta)-13-[(trimethylsilyl)oxy]kaur-16-en-18-oate Methyl ent-13-(trimethylsilyloxy)kaur-16-en-19-oate
Comments Less than 3 mono-isotopic peaks
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Formula C24H40O3Si
InChI InChI=1S/C24H40O3Si/c1-17-15-23-13-9-18-21(2,11-8-12-22(18,3)20(25)26-4)19(23)10-14-24(17,16-23)27-28(5,6)7/h18-19H,1,8-16H2,2-7H3/t18-,19-,21+,22-,23+,24-/m1/s1
InChIKey XXBLIPZIYGFRNX-UELWMSMESA-N
Molecular Weight 404.666 g/mol
SMILES [C@]123[C@@]([C@]4(CCC[C@]([C@@]4(CC3)[H])(C(=O)OC)C)C)(CC[C@](C2)(O[Si](C)(C)C)C(C1)=C)[H]
SPLASH splash10-0006-0900300000-a2eb55b5b0e582c59e00
Source of Spectrum KO-15-217-2
Wiley ID 1371462