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2-Piperidinecarbonitrile, 3-ethyl-4-(1H-indol-3-yl)-1-methyl-, (2.alpha.,3.beta.,4.beta.)-
SpectraBase Compound ID 9QLHqm9fj6K
InChI InChI=1S/C17H21N3/c1-3-12-13(8-9-20(2)17(12)10-18)15-11-19-16-7-5-4-6-14(15)16/h4-7,11-13,17,19H,3,8-9H2,1-2H3/t12-,13-,17+/m0/s1
InChIKey HFOUCGWTRIORLQ-GDZNZVCISA-N
Mol Weight 267.38 g/mol
Molecular Formula C17H21N3
Exact Mass 267.173548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZaymVPzRqe
Name 2-Piperidinecarbonitrile, 3-ethyl-4-(1H-indol-3-yl)-1-methyl-, (2.alpha.,3.beta.,4.beta.)-
Alternate Name(s) (2S,3S,4S)-3-ethyl-4-(1H-indol-3-yl)-1-methyl-2-piperidinecarbonitrile Aminonitrile
CAS Registry Number 73657-91-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21N3
InChI InChI=1S/C17H21N3/c1-3-12-13(8-9-20(2)17(12)10-18)15-11-19-16-7-5-4-6-14(15)16/h4-7,11-13,17,19H,3,8-9H2,1-2H3/t12-,13-,17+/m0/s1
InChIKey HFOUCGWTRIORLQ-GDZNZVCISA-N
Molecular Weight 267.376 g/mol
SMILES [nH]1c2c(c(c1)[C@@]1([C@@]([C@@](C#N)(N(CC1)C)[H])(CC)[H])[H])cccc2
SPLASH splash10-05r0-5920000000-8f1def3e43acddf0bd3f
Source of Spectrum C-102-1076-0
Wiley ID 1271376