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2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-2-(2-furyl)acetonitrile

View entire compound with spectra: 1 MS (GC)

2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-2-(2-furyl)acetonitrile
SpectraBase Compound ID JLPbcgLS1wA
InChI InChI=1S/C19H22N2O3/c1-19(2)23-13-16(18(24-19)14-8-5-4-6-9-14)21(3)15(12-20)17-10-7-11-22-17/h4-11,15-16,18H,13H2,1-3H3/t15?,16-,18-/m0/s1
InChIKey BMVDCHOBHNHTEA-YLGOGADGSA-N
Mol Weight 326.4 g/mol
Molecular Formula C19H22N2O3
Exact Mass 326.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnDYp4Xj3W0
Name 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-2-(2-furyl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2O3
InChI InChI=1S/C19H22N2O3/c1-19(2)23-13-16(18(24-19)14-8-5-4-6-9-14)21(3)15(12-20)17-10-7-11-22-17/h4-11,15-16,18H,13H2,1-3H3/t15?,16-,18-/m0/s1
InChIKey BMVDCHOBHNHTEA-YLGOGADGSA-N
Molecular Weight 326.396 g/mol
SMILES [C@]1(N(C(c2occc2)C#N)C)([C@@](OC(OC1)(C)C)(c1ccccc1)[H])[H]
SPLASH splash10-08gi-3900000000-624240a6456f882d3bcb
Source of Spectrum SO-0-665-3
Synonyms 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-2-(furan-2-yl)ethanenitrile 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methylamino]-2-(2-furanyl)acetonitrile 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methylamino]-2-(furan-2-yl)acetonitrile
Wiley ID 873054