3-Phenylmethanesulfinylmethyl-2-aza-bicyclo[2.2.1]heptane

SpectraBase Compound ID	5gERrr6ATxA
InChI	InChI=1S/C14H19NOS/c16-17(9-11-4-2-1-3-5-11)10-14-12-6-7-13(8-12)15-14/h1-5,12-15H,6-10H2/t12-,13+,14+,17?/m1/s1
InChIKey	SDQNQSSCHDXGTB-MDVAVASXSA-N Google Search
Mol Weight	249.37 g/mol
Molecular Formula	C14H19NOS
Exact Mass	249.118735 g/mol

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SpectraBase Spectrum ID	BfyoZNnhQll
Name	3-Phenylmethanesulfinylmethyl-2-aza-bicyclo[2.2.1]heptane
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C14H19NOS
InChI	InChI=1S/C14H19NOS/c16-17(9-11-4-2-1-3-5-11)10-14-12-6-7-13(8-12)15-14/h1-5,12-15H,6-10H2/t12-,13+,14+,17?/m1/s1
InChIKey	SDQNQSSCHDXGTB-MDVAVASXSA-N
Molecular Weight	249.372 g/mol
SMILES	N1[C@@]2(C[C@]([C@@]1(CS(=O)Cc1ccccc1)[H])(CC2)[H])[H]
SPLASH	splash10-00kf-9430000000-630b4a61d1a3f9b53065
Source of Spectrum	KC-1-361-7
Synonyms	(1S,3R,4R)-3-Benzylsulfanylmethyl-2-azabicyclo[2.2.1]heptane (1S,3R,4R)-3-Benzylsulfanylmethyl-2-azabicyclo[2.2.1]heptane isomer 2-Azabicyclo[2.2.1]hept-3-ylmethyl benzyl sulfoxide 3-[(benzylsulfinyl)methyl]-2-azabicyclo[2.2.1]heptane
Wiley ID	1577591