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6-Methyl-11,12-dioxatricyclo[7.2.1.0(1,6)]dodecan-5-ol-8-carboxylic acid, methyl ester p-tosylate
SpectraBase Compound ID IAR56YYFBu6
InChI InChI=1S/C20H26O7S/c1-13-6-8-14(9-7-13)28(22,23)27-17-5-4-10-20-19(17,2)11-15(18(21)24-3)16(26-20)12-25-20/h6-9,15-17H,4-5,10-12H2,1-3H3
InChIKey YZPWCQOVOGAPKO-UHFFFAOYSA-N
Mol Weight 410.48 g/mol
Molecular Formula C20H26O7S
Exact Mass 410.139924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dMsUjH9kxM
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H26O7S
InChI InChI=1S/C20H26O7S/c1-13-6-8-14(9-7-13)28(22,23)27-17-5-4-10-20-19(17,2)11-15(18(21)24-3)16(26-20)12-25-20/h6-9,15-17H,4-5,10-12H2,1-3H3
InChIKey YZPWCQOVOGAPKO-UHFFFAOYSA-N
Molecular Weight 410.1392
SMILES c1cc(C)ccc1S(OC1C2(CC(C(OC)=O)C3COC2(O3)CCC1)C)(=O)=O
SPLASH splash10-000i-9870000000-b5bb6d03c0e0e7dad44f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany