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2,2-Dimethyl-4-phenyl-N-(6'-(chlorohex-5'-en-3'-yn-2'-yl)-1,3-dioxan-5-amine
SpectraBase Compound ID Cu5B1A6E8hX
InChI InChI=1S/C18H22ClNO2/c1-14(9-7-8-12-19)20-16-13-21-18(2,3)22-17(16)15-10-5-4-6-11-15/h4-6,8,10-12,14,16-17,20H,13H2,1-3H3/b12-8+/t14-,16-,17-/m0/s1
InChIKey NOQZJDAMTYFHEJ-CEDDZFRUSA-N
Mol Weight 319.83 g/mol
Molecular Formula C18H22ClNO2
Exact Mass 319.133907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IukuAouu5S8
Name 2,2-Dimethyl-4-phenyl-N-(6'-(chlorohex-5'-en-3'-yn-2'-yl)-1,3-dioxan-5-amine
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Formula C18H22ClNO2
InChI InChI=1S/C18H22ClNO2/c1-14(9-7-8-12-19)20-16-13-21-18(2,3)22-17(16)15-10-5-4-6-11-15/h4-6,8,10-12,14,16-17,20H,13H2,1-3H3/b12-8+/t14-,16-,17-/m0/s1
InChIKey NOQZJDAMTYFHEJ-CEDDZFRUSA-N
Molecular Weight 319.832 g/mol
SMILES N([C@@]1([C@@](OC(OC1)(C)C)(c1ccccc1)[H])[H])[C@](C#C\C=C\Cl)(C)[H]
SPLASH splash10-0abc-1900000000-2ee79dcaefeff7a15b40
Source of Spectrum H-78-987-11
Synonyms ((E)-(S)-5-Chloro-1-methyl-pent-4-en-2-ynyl)-((4S,5S)-2,2-dimethyl-4-phenyl-[1,3]dioxan-5-yl)-amine N-[(4E)-5-chloro-1-methyl-4-penten-2-ynyl]-2,2-dimethyl-4-phenyl-1,3-dioxan-5-amine N-[(4E)-5-chloro-1-methyl-4-penten-2-ynyl]-N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)amine
Wiley ID 1319386