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trans-N-Boc-2-(1-methylethyl)-6-butyl-4-piperidinone
SpectraBase Compound ID LS5ez9cBMLi
InChI InChI=1S/C17H31NO3/c1-7-8-9-13-10-14(19)11-15(12(2)3)18(13)16(20)21-17(4,5)6/h12-13,15H,7-11H2,1-6H3/t13-,15+/m1/s1
InChIKey MJHOOHXNLXNOSP-HIFRSBDPSA-N
Mol Weight 297.44 g/mol
Molecular Formula C17H31NO3
Exact Mass 297.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40Ar4OSn4IK
Name trans-N-Boc-2-(1-methylethyl)-6-butyl-4-piperidinone
Alternate Name(s) (2R,6S)-tert-butyl 2-butyl-6-isopropyl-4-oxopiperidine-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H31NO3
InChI InChI=1S/C17H31NO3/c1-7-8-9-13-10-14(19)11-15(12(2)3)18(13)16(20)21-17(4,5)6/h12-13,15H,7-11H2,1-6H3/t13-,15+/m1/s1
InChIKey MJHOOHXNLXNOSP-HIFRSBDPSA-N
Literature Reference DOI 10.1021/jo400936z
Molecular Weight 297.439 g/mol
SMILES C1[C@@](C(C)C)(N([C@@](CC1=O)(CCCC)[H])C(=O)OC(C)(C)C)[H]
SPLASH splash10-0a4l-9750000000-59b917a03fadc08ce9c9
Source of Spectrum J-78-8461-13b
Wiley ID 1745575