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

*Links on SpectraBase are not permalinks.
Tetraethyl (6-(furan-2-yl)-5,6-dihydro-[1,2,4]triazolo[3,4-b] [1,3,4]thiadiazol-6-yl)-methylenediphosphonate
SpectraBase Compound ID IxiIQjc1e1V
InChI InChI=1S/C16H26N4O7P2S/c1-5-24-28(21,25-6-2)14(29(22,26-7-3)27-8-4)16(13-10-9-11-23-13)19-20-12-17-18-15(20)30-16/h9-12,14,19H,5-8H2,1-4H3
InChIKey RDFWKYVVRGSFLV-UHFFFAOYSA-N
Mol Weight 480.41 g/mol
Molecular Formula C16H26N4O7P2S
Exact Mass 480.099744 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 FDJxuLBLgN6
Name Tetraethyl (6-(furan-2-yl)-5,6-dihydro-[1,2,4]triazolo[3,4-b] [1,3,4]thiadiazol-6-yl)-methylenediphosphonate
Appearance Colorless
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26N4O7P2S
InChI InChI=1S/C16H26N4O7P2S/c1-5-24-28(21,25-6-2)14(29(22,26-7-3)27-8-4)16(13-10-9-11-23-13)19-20-12-17-18-15(20)30-16/h9-12,14,19H,5-8H2,1-4H3
InChIKey RDFWKYVVRGSFLV-UHFFFAOYSA-N
Instrument Name MS-50 Kratos
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2306
Molecular Weight 480.413 g/mol
SMILES N1[n]2c(SC1(c1occc1)C(P(=O)(OCC)OCC)P(OCC)(=O)OCC)nnc2
SPLASH splash10-00ko-4950200000-8708d9d24f1c3551e9fd
Source of Spectrum Y-53-531-4l
Wiley ID 1876345