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4-(2-Iodopropan-2-yl)-1-(phenylsulfonyl)piperidine
SpectraBase Compound ID 7f1ctmopdFU
InChI InChI=1S/C14H20INO2S/c1-14(2,15)12-8-10-16(11-9-12)19(17,18)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3
InChIKey KRLSHPUYUKDLQR-UHFFFAOYSA-N
Mol Weight 393.28 g/mol
Molecular Formula C14H20INO2S
Exact Mass 393.025945 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kt0IEzC9pTE
Name 4-(2-Iodopropan-2-yl)-1-(phenylsulfonyl)piperidine
Appearance Light yellow solid
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Formula C14H20INO2S
InChI InChI=1S/C14H20INO2S/c1-14(2,15)12-8-10-16(11-9-12)19(17,18)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3
InChIKey KRLSHPUYUKDLQR-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201708197
Molecular Weight 393.283 g/mol
Quality 135
Reported Formula C14H20NO2SI
SMILES C1=CC(=CC=C1)S(N1CCC(CC1)C(I)(C)C)(=O)=O
SPLASH splash10-00di-3940000000-8d42badd5fae3a9bc00c
Source of Spectrum ACI-56-SM11-I-1t (DOI: 10.1002/anie.201708197)
Wiley ID 1896588