3-formyl-2-[(4-methylphenyl)sulfinyl]bicyclo[2.2.1]hept-5-ene-2-carbonitrile

SpectraBase Compound ID	98Pd06mrznj
InChI	InChI=1S/C16H15NO2S/c1-11-2-6-14(7-3-11)20(19)16(10-17)13-5-4-12(8-13)15(16)9-18/h2-7,9,12-13,15H,8H2,1H3/t12-,13+,15-,16+,20?/m1/s1
InChIKey	JSGHJTGHVNEPMK-UCYCLZEPSA-N Google Search
Mol Weight	285.36 g/mol
Molecular Formula	C16H15NO2S
Exact Mass	285.08235 g/mol

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SpectraBase Spectrum ID	16n3JD69YW
Name	3-formyl-2-[(4-methylphenyl)sulfinyl]bicyclo[2.2.1]hept-5-ene-2-carbonitrile
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H15NO2S
InChI	InChI=1S/C16H15NO2S/c1-11-2-6-14(7-3-11)20(19)16(10-17)13-5-4-12(8-13)15(16)9-18/h2-7,9,12-13,15H,8H2,1H3/t12-,13+,15-,16+,20?/m1/s1
InChIKey	JSGHJTGHVNEPMK-UCYCLZEPSA-N
Molecular Weight	285.361 g/mol
SMILES	[C@@]1(S(c2ccc(cc2)C)=O)([C@]2(C=C[C@@]([C@]1(C=O)[H])(C2)[H])[H])C#N
SPLASH	splash10-014l-9400000000-6233ed112dcc059cfd7e
Source of Spectrum	KD-13-2009-6
Synonyms	(1R,2S,3R,4S,Ss)-3-Formyl-2-[(4-methylphenyl)sulfinyl]bicyclo[2.2.1]hept-5-ene-2-carbonitrile
Wiley ID	1635518