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2,2-Dimethyl-4-phenyl-N-(4'-phenylhept-1'-yn-3'-yl)-1,3-dioxan-5-amine
SpectraBase Compound ID 6LTJ4kAhTrr
InChI InChI=1S/C25H31NO2/c1-5-13-21(19-14-9-7-10-15-19)22(6-2)26-23-18-27-25(3,4)28-24(23)20-16-11-8-12-17-20/h2,7-12,14-17,21-24,26H,5,13,18H2,1,3-4H3
InChIKey WMSCBYFUUXOQPP-UHFFFAOYSA-N
Mol Weight 377.53 g/mol
Molecular Formula C25H31NO2
Exact Mass 377.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLZY2fFXIgz
Name 2,2-Dimethyl-4-phenyl-N-(4'-phenylhept-1'-yn-3'-yl)-1,3-dioxan-5-amine
Alternate Name(s) 2,2-Dimethyl-4-phenyl-N-[1-(1-phenylbutyl)-2-propynyl]-1,3-dioxan-5-amine N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)-N-[1-(1-phenylbutyl)-2-propynyl]amine
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Formula C25H31NO2
InChI InChI=1S/C25H31NO2/c1-5-13-21(19-14-9-7-10-15-19)22(6-2)26-23-18-27-25(3,4)28-24(23)20-16-11-8-12-17-20/h2,7-12,14-17,21-24,26H,5,13,18H2,1,3-4H3
InChIKey WMSCBYFUUXOQPP-UHFFFAOYSA-N
Molecular Weight 377.528 g/mol
SMILES N(C1C(OC(OC1)(C)C)c1ccccc1)C(C#C)C(c1ccccc1)CCC
SPLASH splash10-0a4i-1920000000-ad16642553979a9a3e91
Source of Spectrum H-78-981-4
Wiley ID 1358369