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(3R*,4R*)-1-tert-Butyl-4-(iodomethyl)-3-isopropylpiperidin-2-one
SpectraBase Compound ID BtqGh5F996v
InChI InChI=1S/C13H24INO/c1-9(2)11-10(8-14)6-7-15(12(11)16)13(3,4)5/h9-11H,6-8H2,1-5H3/t10-,11+/m0/s1
InChIKey QDQSVSJAYKGSEH-WDEREUQCSA-N
Mol Weight 337.25 g/mol
Molecular Formula C13H24INO
Exact Mass 337.090259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZojadbIye
Name (3R*,4R*)-1-tert-Butyl-4-(iodomethyl)-3-isopropylpiperidin-2-one
Alternate Name(s) (3R,4R)-1-(tert-butyl)-4-(iodomethyl)-3-isopropylpiperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24INO
InChI InChI=1S/C13H24INO/c1-9(2)11-10(8-14)6-7-15(12(11)16)13(3,4)5/h9-11H,6-8H2,1-5H3/t10-,11+/m0/s1
InChIKey QDQSVSJAYKGSEH-WDEREUQCSA-N
Literature Reference DOI 10.1021/acs.joc.6b00008
Molecular Weight 337.245 g/mol
SMILES C1(N(CC[C@]([C@]1(C(C)C)[H])(CI)[H])C(C)(C)C)=O
SPLASH splash10-0cdl-9810000000-10ab9419f443dd176d4e
Source of Spectrum J-81-2448-cis_16d
Wiley ID 1804395