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2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-2-phenyl-acetonitrile
SpectraBase Compound ID AiNESJ2m7VJ
InChI InChI=1S/C21H24N2O2/c1-21(2)24-15-19(20(25-21)17-12-8-5-9-13-17)23(3)18(14-22)16-10-6-4-7-11-16/h4-13,18-20H,15H2,1-3H3/t18?,19-,20-/m0/s1
InChIKey MQWWOXXSTIKUOZ-YPJRHXLCSA-N
Mol Weight 336.44 g/mol
Molecular Formula C21H24N2O2
Exact Mass 336.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJgIT2KAAvu
Name 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-2-phenyl-acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N2O2
InChI InChI=1S/C21H24N2O2/c1-21(2)24-15-19(20(25-21)17-12-8-5-9-13-17)23(3)18(14-22)16-10-6-4-7-11-16/h4-13,18-20H,15H2,1-3H3/t18?,19-,20-/m0/s1
InChIKey MQWWOXXSTIKUOZ-YPJRHXLCSA-N
Molecular Weight 336.435 g/mol
SMILES [C@]1(N(C(C#N)c2ccccc2)C)([C@@](OC(OC1)(C)C)(c1ccccc1)[H])[H]
SPLASH splash10-00e9-1900000000-16e7c1c490e1a3d4a043
Source of Spectrum SO-0-661-3
Synonyms 2-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-2-phenyl-ethanenitrile
Wiley ID 873056