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endo-(R1,S2,R4,Rs)-Benzyl 2-(p-tolylsulfinyl)bicyclo[2.2.1]hept-5-ene-2-carboxylate
SpectraBase Compound ID BrLovAt3LsG
InChI InChI=1S/C22H22O3S/c1-15-7-11-19(12-8-15)26(24)21-18-10-9-17(13-18)20(21)22(23)25-14-16-5-3-2-4-6-16/h2-12,17-18,20-21H,13-14H2,1H3/t17-,18+,20-,21-,26?/m1/s1
InChIKey CWFFZNYEVIFQDV-VJEIAZOPSA-N
Mol Weight 366.48 g/mol
Molecular Formula C22H22O3S
Exact Mass 366.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55uQTuRAQH5
Name endo-(R1,S2,R4,Rs)-Benzyl 2-(p-tolylsulfinyl)bicyclo[2.2.1]hept-5-ene-2-carboxylate
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Formula C22H22O3S
InChI InChI=1S/C22H22O3S/c1-15-7-11-19(12-8-15)26(24)21-18-10-9-17(13-18)20(21)22(23)25-14-16-5-3-2-4-6-16/h2-12,17-18,20-21H,13-14H2,1H3/t17-,18+,20-,21-,26?/m1/s1
InChIKey CWFFZNYEVIFQDV-VJEIAZOPSA-N
Molecular Weight 366.475 g/mol
SMILES [C@]1([C@@]([C@]2(C[C@@]1(C=C2)[H])[H])(C(OCc1ccccc1)=O)[H])(S(c1ccc(cc1)C)=O)[H]
SPLASH splash10-0006-9100000000-e0dcd5f474ff17885503
Source of Spectrum QC-8-2222-6
Synonyms endo-Benzyl 2-(p-tolylsulfinyl)bicyclo[2.2.1]hept-5-ene-2-carboxylate
Wiley ID 870071