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3,4-Dihydro-2-methoxy-3,7-diphenyl-5H-1,3-dioxazino[5',4':4,5]thieno[2,3-d]pyrimidin-4,5-dione
SpectraBase Compound ID GEi16hO6nF2
InChI InChI=1S/C21H13N3O4S/c1-27-21-23-17-14(19(25)24(21)13-10-6-3-7-11-13)15-18(29-17)22-16(28-20(15)26)12-8-4-2-5-9-12/h2-11H,1H3
InChIKey VGXYQVXZBIFZAP-UHFFFAOYSA-N
Mol Weight 403.41 g/mol
Molecular Formula C21H13N3O4S
Exact Mass 403.062677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JX12dx2ATBr
Name 3,4-Dihydro-2-methoxy-3,7-diphenyl-5H-1,3-dioxazino[5',4':4,5]thieno[2,3-d]pyrimidin-4,5-dione
Alternate Name(s) 7-methoxy-2,6-diphenyl-4H-pyrimido[5',4':4,5]thieno[2,3-d][1,3]oxazine-4,5(6H)-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13N3O4S
InChI InChI=1S/C21H13N3O4S/c1-27-21-23-17-14(19(25)24(21)13-10-6-3-7-11-13)15-18(29-17)22-16(28-20(15)26)12-8-4-2-5-9-12/h2-11H,1H3
InChIKey VGXYQVXZBIFZAP-UHFFFAOYSA-N
Molecular Weight 403.412 g/mol
SMILES c12c(N=C(N(C2=O)c2ccccc2)OC)sc2c1C(OC(c1ccccc1)=N2)=O
SPLASH splash10-0a4i-0900400000-ab4876d723948f641ad5
Source of Spectrum F-49-588-9
Wiley ID 1370840