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(3R*,4R*)-1-tert-Butyl-3-butyl-4-(iodomethyl)piperidin-2-one
SpectraBase Compound ID 1uTZc4ey1me
InChI InChI=1S/C14H26INO/c1-5-6-7-12-11(10-15)8-9-16(13(12)17)14(2,3)4/h11-12H,5-10H2,1-4H3/t11-,12+/m0/s1
InChIKey FMISMZCKXQGKRO-NWDGAFQWSA-N
Mol Weight 351.27 g/mol
Molecular Formula C14H26INO
Exact Mass 351.105909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GvJEMAbUrD
Name (3R*,4R*)-1-tert-Butyl-3-butyl-4-(iodomethyl)piperidin-2-one
Alternate Name(s) (3R,4R)-1-(tert-butyl)-3-butyl-4-(iodomethyl)piperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26INO
InChI InChI=1S/C14H26INO/c1-5-6-7-12-11(10-15)8-9-16(13(12)17)14(2,3)4/h11-12H,5-10H2,1-4H3/t11-,12+/m0/s1
InChIKey FMISMZCKXQGKRO-NWDGAFQWSA-N
Literature Reference DOI 10.1021/acs.joc.6b00008
Molecular Weight 351.272 g/mol
SMILES C1(N(CC[C@]([C@]1(CCCC)[H])(CI)[H])C(C)(C)C)=O
SPLASH splash10-07vi-7910000000-4c82605484c7da722aa9
Source of Spectrum J-81-2448-cis_16c
Wiley ID 1804394