3-[(3S)-1-butyl-3-piperidinyl]benzonitrile

SpectraBase Compound ID	IzoLZyZhqUA
InChI	InChI=1S/C16H22N2/c1-2-3-9-18-10-5-8-16(13-18)15-7-4-6-14(11-15)12-17/h4,6-7,11,16H,2-3,5,8-10,13H2,1H3/t16-/m1/s1
InChIKey	RBAZQAAINJJBRX-MRXNPFEDSA-N Google Search
Mol Weight	242.37 g/mol
Molecular Formula	C16H22N2
Exact Mass	242.178299 g/mol

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SpectraBase Spectrum ID	3rlEIICm0hA
Name	3-[(3S)-1-butyl-3-piperidinyl]benzonitrile
Alternate Name(s)	3-[(3S)-1-butyl-3-piperidyl]benzonitrile 3-[(3S)-1-butylpiperidin-3-yl]benzenecarbonitrile 3-[(3S)-1-butylpiperidin-3-yl]benzonitrile
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H22N2
InChI	InChI=1S/C16H22N2/c1-2-3-9-18-10-5-8-16(13-18)15-7-4-6-14(11-15)12-17/h4,6-7,11,16H,2-3,5,8-10,13H2,1H3/t16-/m1/s1
InChIKey	RBAZQAAINJJBRX-MRXNPFEDSA-N
Molecular Weight	242.366 g/mol
SMILES	C(#N)c1cc([C@]2(CN(CCCC)CCC2)[H])ccc1
SPLASH	splash10-0002-0910000000-d3a2b882bde0f7805fc7
Source of Spectrum	E1-37-2749-32
Wiley ID	1575182