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(3R,6R)-2,3-dimethyl-5-(4-nitrobenzyl)-6-phenyl-1,2,5-oxadiazinane
SpectraBase Compound ID IfgpvpinBdA
InChI InChI=1S/C18H21N3O3/c1-14-12-20(13-15-8-10-17(11-9-15)21(22)23)18(24-19(14)2)16-6-4-3-5-7-16/h3-11,14,18H,12-13H2,1-2H3/t14-,18-/m1/s1
InChIKey XNWNBLQGGNBJKD-RDTXWAMCSA-N
Mol Weight 327.38 g/mol
Molecular Formula C18H21N3O3
Exact Mass 327.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AE6PtL9g2wL
Name (3R,6R)-2,3-dimethyl-5-(4-nitrobenzyl)-6-phenyl-1,2,5-oxadiazinane
Alternate Name(s) (3R,6R)-2,3-dimethyl-5-[(4-nitrophenyl)methyl]-6-phenyl-1,2,5-oxadiazinane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N3O3
InChI InChI=1S/C18H21N3O3/c1-14-12-20(13-15-8-10-17(11-9-15)21(22)23)18(24-19(14)2)16-6-4-3-5-7-16/h3-11,14,18H,12-13H2,1-2H3/t14-,18-/m1/s1
InChIKey XNWNBLQGGNBJKD-RDTXWAMCSA-N
Molecular Weight 327.384 g/mol
SMILES [C@@]1(N(C[C@](N(O1)C)(C)[H])Cc1ccc(N(=O)=O)cc1)(c1ccccc1)[H]
SPLASH splash10-004i-7029000000-346de14ab02630173451
Source of Spectrum KC-0-3303-58
Wiley ID 831815