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[(2S,3R,5R)-2-Methyl-5-phenylmorpholin-3-yl]acetonitrile
SpectraBase Compound ID 3UpsdKbdthL
InChI InChI=1S/C13H16N2O/c1-10-12(7-8-14)15-13(9-16-10)11-5-3-2-4-6-11/h2-6,10,12-13,15H,7,9H2,1H3/t10-,12+,13-/m0/s1
InChIKey UJAIUGQUGBEZEN-UHTWSYAYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C13H16N2O
Exact Mass 216.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vaYM5cXJ2
Name [(2S,3R,5R)-2-Methyl-5-phenylmorpholin-3-yl]acetonitrile
Alternate Name(s) [(2S,3R,5R)-2-methyl-5-phenylmorpholinyl]acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O
InChI InChI=1S/C13H16N2O/c1-10-12(7-8-14)15-13(9-16-10)11-5-3-2-4-6-11/h2-6,10,12-13,15H,7,9H2,1H3/t10-,12+,13-/m0/s1
InChIKey UJAIUGQUGBEZEN-UHTWSYAYSA-N
Molecular Weight 216.284 g/mol
SMILES N1[C@@]([C@@](OC[C@]1(c1ccccc1)[H])(C)[H])(CC#N)[H]
SPLASH splash10-0f6t-1900000000-4a0b96752bd117db1ef6
Source of Spectrum KD-14-2656-7
Wiley ID 1636288