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3,4-Dimethoxyphenyl-[(2',2'-dimethyl-4'-phenyl[1,3]dioxan-5'-yl]metyhylamino[acetonitrile

View entire compound with spectra: 1 MS (GC)

3,4-Dimethoxyphenyl-[(2',2'-dimethyl-4'-phenyl[1,3]dioxan-5'-yl]metyhylamino[acetonitrile
SpectraBase Compound ID Jg0wxnJVQYp
InChI InChI=1S/C23H28N2O4/c1-23(2)28-15-19(22(29-23)16-9-7-6-8-10-16)25(3)18(14-24)17-11-12-20(26-4)21(13-17)27-5/h6-13,18-19,22H,15H2,1-5H3/t18?,19-,22-/m0/s1
InChIKey DDQDYTOVTWRGSR-MLLWHUAMSA-N
Mol Weight 396.49 g/mol
Molecular Formula C23H28N2O4
Exact Mass 396.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hxwsID8Tce
Name 3,4-Dimethoxyphenyl-[(2',2'-dimethyl-4'-phenyl[1,3]dioxan-5'-yl]metyhylamino[acetonitrile
Alternate Name(s) (3,4-Dimethoxy-phenyl)-[((4S,5S)-2,2-dimethyl-4-phenyl-[1,3]dioxan-5-yl)-methyl-amino]-acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28N2O4
InChI InChI=1S/C23H28N2O4/c1-23(2)28-15-19(22(29-23)16-9-7-6-8-10-16)25(3)18(14-24)17-11-12-20(26-4)21(13-17)27-5/h6-13,18-19,22H,15H2,1-5H3/t18?,19-,22-/m0/s1
InChIKey DDQDYTOVTWRGSR-MLLWHUAMSA-N
Molecular Weight 396.487 g/mol
SMILES [C@]1(N(C(c2cc(c(OC)cc2)OC)C#N)C)([C@@](OC(OC1)(C)C)(c1ccccc1)[H])[H]
SPLASH splash10-004i-0930000000-aab44bbb105c6b931815
Source of Spectrum U-1996-1364-3
Wiley ID 768839