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Toluene-4-sulfonic acid, 7-oxabicyclo[2.2.1]hept-2-ylmethyl ester
SpectraBase Compound ID 75n148VOc5d
InChI InChI=1S/C14H18O4S/c1-10-2-5-13(6-3-10)19(15,16)17-9-11-8-12-4-7-14(11)18-12/h2-3,5-6,11-12,14H,4,7-9H2,1H3/t11-,12-,14+/m1/s1
InChIKey PNWQDGADYLNCMH-BZPMIXESSA-N
Mol Weight 282.35 g/mol
Molecular Formula C14H18O4S
Exact Mass 282.09258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lbKgedaSmy
Name TOLUENE-4-SULFONIC ACID 7-OXA-BICYCLO[2.2.1]HEPT-2-YLMETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H18O4S
InChI InChI=1S/C14H18O4S/c1-10-2-5-13(6-3-10)19(15,16)17-9-11-8-12-4-7-14(11)18-12/h2-3,5-6,11-12,14H,4,7-9H2,1H3/t11-,12-,14+/m1/s1
InChIKey PNWQDGADYLNCMH-BZPMIXESSA-N
Molecular Weight 282.0921
SMILES C1C[C@@]2(C[C@](COS(=O)(=O)c3ccc(C)cc3)([C@]1(O2)[H])[H])[H]
SPLASH splash10-014l-9200000000-f95292677d948921479b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany