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(S)-(-)-3-(1-sec-Butylpiperidin-3-yl)benzonitrile
SpectraBase Compound ID Aqtz0qP9DL6
InChI InChI=1S/C16H22N2/c1-3-13(2)18-9-5-8-16(12-18)15-7-4-6-14(10-15)11-17/h4,6-7,10,13,16H,3,5,8-9,12H2,1-2H3
InChIKey TYYIXERJKMDZBL-UHFFFAOYSA-N
Mol Weight 242.37 g/mol
Molecular Formula C16H22N2
Exact Mass 242.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CDw7vj5oe0G
Name (S)-(-)-3-(1-sec-Butylpiperidin-3-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2
InChI InChI=1S/C16H22N2/c1-3-13(2)18-9-5-8-16(12-18)15-7-4-6-14(10-15)11-17/h4,6-7,10,13,16H,3,5,8-9,12H2,1-2H3
InChIKey TYYIXERJKMDZBL-UHFFFAOYSA-N
Molecular Weight 242.366 g/mol
SMILES C1N(CCCC1c1cc(C#N)ccc1)C(CC)C
SPLASH splash10-03di-0190000000-c3efaae0823cf20ffb30
Source of Spectrum E1-37-2749-33
Synonyms 3-(1-butan-2-yl-3-piperidinyl)benzonitrile 3-(1-butan-2-ylpiperidin-3-yl)benzenecarbonitrile 3-(1-butan-2-ylpiperidin-3-yl)benzonitrile 3-(1-sec-butyl-3-piperidinyl)benzonitrile 3-(1-sec-butyl-3-piperidyl)benzonitrile
Wiley ID 1575181