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(7S,8R)-7-butyl-5,5-dimethyl-2-phenyl-8-prop-1-en-2-yl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-dione
SpectraBase Compound ID DuY0CQmcm80
InChI InChI=1S/C20H27N3O3/c1-6-7-13-16-17(14(2)3)22-18(24)21(15-11-9-8-10-12-15)19(25)23(22)20(4,5)26-16/h8-12,16-17H,2,6-7,13H2,1,3-5H3/t16-,17+/m0/s1
InChIKey NPVNKWIPSVRYPW-DLBZAZTESA-N
Mol Weight 357.45 g/mol
Molecular Formula C20H27N3O3
Exact Mass 357.205242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZ81sUj9y95
Name (7S,8R)-7-butyl-5,5-dimethyl-2-phenyl-8-prop-1-en-2-yl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-dione
Alternate Name(s) (7S,8R)-7-butyl-5,5-dimethyl-8-(1-methylethenyl)-2-phenyl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-dione (7S,8R)-7-butyl-8-isopropenyl-5,5-dimethyl-2-phenyl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-dione (7S,8R)-7-butyl-8-isopropenyl-5,5-dimethyl-2-phenyl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-quinone
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Formula C20H27N3O3
InChI InChI=1S/C20H27N3O3/c1-6-7-13-16-17(14(2)3)22-18(24)21(15-11-9-8-10-12-15)19(25)23(22)20(4,5)26-16/h8-12,16-17H,2,6-7,13H2,1,3-5H3/t16-,17+/m0/s1
InChIKey NPVNKWIPSVRYPW-DLBZAZTESA-N
Molecular Weight 357.454 g/mol
SMILES C1(N2N(C(N1c1ccccc1)=O)C(O[C@]([C@]2(C(=C)C)[H])(CCCC)[H])(C)C)=O
SPLASH splash10-00lr-9800000000-06ec8a40047ae5dd586b
Source of Spectrum J-64-2201-5
Wiley ID 1529695