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(2-sulfanylidenepyridin-1-yl) 1-(4-methoxyphenyl)bicyclo[1.1.1]pentane-3-carboxylate
SpectraBase Compound ID BVSvcVhgTay
InChI InChI=1S/C18H17NO3S/c1-21-14-7-5-13(6-8-14)17-10-18(11-17,12-17)16(20)22-19-9-3-2-4-15(19)23/h2-9H,10-12H2,1H3
InChIKey FFYWFXAWPHKHHU-UHFFFAOYSA-N
Mol Weight 327.4 g/mol
Molecular Formula C18H17NO3S
Exact Mass 327.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XAKA0wZAO
Name (2-sulfanylidenepyridin-1-yl) 1-(4-methoxyphenyl)bicyclo[1.1.1]pentane-3-carboxylate
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Formula C18H17NO3S
InChI InChI=1S/C18H17NO3S/c1-21-14-7-5-13(6-8-14)17-10-18(11-17,12-17)16(20)22-19-9-3-2-4-15(19)23/h2-9H,10-12H2,1H3
InChIKey FFYWFXAWPHKHHU-UHFFFAOYSA-N
Molecular Weight 327.398 g/mol
SMILES C12(C(ON3C(=S)C=CC=C3)=O)CC(C1)(c1ccc(cc1)OC)C2
SPLASH splash10-0c04-9210000000-56649fbbc82bebdb47a1
Source of Spectrum J-59-2995-65
Synonyms (2-thioxo-1-pyridyl) 1-(4-methoxyphenyl)bicyclo[1.1.1]pentane-3-carboxylate 1-(4-Methoxyphenyl)-3-bicyclo[1.1.1]pentanecarboxylic acid (2-sulfanylidene-1-pyridinyl) ester 1-(4-Methoxyphenyl)bicyclo[1.1.1]pentane-3-carboxylic acid (2-thioxo-1-pyridyl) ester
Wiley ID 1325506