For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(7S,8R)-5,5-dimethyl-2-phenyl-8-prop-1-en-2-yl-7-prop-2-enyl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-dione

View entire compound with spectra: 1 MS (GC)

(7S,8R)-5,5-dimethyl-2-phenyl-8-prop-1-en-2-yl-7-prop-2-enyl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-dione
SpectraBase Compound ID LCDxujlMcBQ
InChI InChI=1S/C19H23N3O3/c1-6-10-15-16(13(2)3)21-17(23)20(14-11-8-7-9-12-14)18(24)22(21)19(4,5)25-15/h6-9,11-12,15-16H,1-2,10H2,3-5H3/t15-,16+/m0/s1
InChIKey VQCMXVZPXGDQEG-JKSUJKDBSA-N
Mol Weight 341.41 g/mol
Molecular Formula C19H23N3O3
Exact Mass 341.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9bYSSt4WHsD
Name (7S,8R)-5,5-dimethyl-2-phenyl-8-prop-1-en-2-yl-7-prop-2-enyl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-dione
Alternate Name(s) (7S,8R)-5,5-dimethyl-8-(1-methylethenyl)-2-phenyl-7-prop-2-enyl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-dione (7S,8R)-7-allyl-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-allyl-8-isopropenyl-5,5-dimethyl-2-phenyl-7,8-dihydro-[1,2,4]triazolo[1,2-c][1,3,4]oxadiazine-1,3-quinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23N3O3
InChI InChI=1S/C19H23N3O3/c1-6-10-15-16(13(2)3)21-17(23)20(14-11-8-7-9-12-14)18(24)22(21)19(4,5)25-15/h6-9,11-12,15-16H,1-2,10H2,3-5H3/t15-,16+/m0/s1
InChIKey VQCMXVZPXGDQEG-JKSUJKDBSA-N
Molecular Weight 341.411 g/mol
SMILES C1(N2N(C(N1c1ccccc1)=O)C(O[C@]([C@]2(C(=C)C)[H])(CC=C)[H])(C)C)=O
SPLASH splash10-014i-0901000000-3d0d953cf2536996b6a0
Source of Spectrum J-64-2201-5
Wiley ID 1529692