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N-(cis-4-iodocyclohexyl)-N-methylbenzamide
SpectraBase Compound ID H6wueo9tIbp
InChI InChI=1S/C14H18INO/c1-16(13-9-7-12(15)8-10-13)14(17)11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3/t12-,13+
InChIKey ITDBMAGPMVHXSX-BETUJISGSA-N
Mol Weight 343.21 g/mol
Molecular Formula C14H18INO
Exact Mass 343.043309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IvdFjmhr6zk
Name N-(cis-4-iodocyclohexyl)-N-methylbenzamide
Alternate Name(s) N-((1s,4s)-4-iodocyclohexyl)-N-methylbenzamide
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Formula C14H18INO
InChI InChI=1S/C14H18INO/c1-16(13-9-7-12(15)8-10-13)14(17)11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3/t12-,13+
InChIKey ITDBMAGPMVHXSX-BETUJISGSA-N
Literature Reference DOI 10.1021/ol403673e
Molecular Weight 343.208 g/mol
SMILES C1[C@](CC[C@](C1)(N(C)C(=O)c1ccccc1)[H])(I)[H]
SPLASH splash10-0aor-2942000000-7457879f1fe84e4465a2
Source of Spectrum A1-16-924/SM10-1e
Wiley ID 1747706