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(3S*,6S*)-6-(Diiodomethyl)-3-isopropylpiperidin-2-one
SpectraBase Compound ID 96EofZvQauU
InChI InChI=1S/C9H15I2NO/c1-5(2)6-3-4-7(8(10)11)12-9(6)13/h5-8H,3-4H2,1-2H3,(H,12,13)/t6-,7-/m0/s1
InChIKey MEHKRSZHSFWFHB-BQBZGAKWSA-N
Mol Weight 407.03 g/mol
Molecular Formula C9H15I2NO
Exact Mass 406.924304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lheh1OD8HDt
Name (3S*,6S*)-6-(Diiodomethyl)-3-isopropylpiperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15I2NO
InChI InChI=1S/C9H15I2NO/c1-5(2)6-3-4-7(8(10)11)12-9(6)13/h5-8H,3-4H2,1-2H3,(H,12,13)/t6-,7-/m0/s1
InChIKey MEHKRSZHSFWFHB-BQBZGAKWSA-N
Literature Reference DOI 10.1021/jo2014406
Molecular Weight 407.034 g/mol
SMILES N1C([C@@](CC[C@]1(C(I)I)[H])(C(C)C)[H])=O
SPLASH splash10-0006-9300000000-c1b942145c100be39154
Source of Spectrum J-76-8104-trans_2c
Synonyms (3S,6S)-6-(diiodomethyl)-3-isopropylpiperidin-2-one (3S,6S)-6-(diiodomethyl)-3-propan-2-yl-2-piperidinone (3S,6S)-6-(diiodomethyl)-3-propan-2-ylpiperidin-2-one (3S,6S)-6-(diiodomethyl)-3-isopropyl-piperidin-2-one (3S,6S)-6-[bis(iodanyl)methyl]-3-propan-2-yl-piperidin-2-one
Wiley ID 1746871