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

*Links on SpectraBase are not permalinks.
4-AMINO-4'-BENZYL-2,7-DINITRO-4',5'-DIHYDROSPIRO-[FLUOREN-9,3'-(1,2,4-TRIAZOLE)]-5'-THIONE
SpectraBase Compound ID AAOQXpnFYcV
InChI InChI=1S/C21H14N6O4S/c22-18-10-14(27(30)31)9-17-19(18)15-7-6-13(26(28)29)8-16(15)21(17)24-23-20(32)25(21)11-12-4-2-1-3-5-12/h1-10H,11,22H2
InChIKey LPFWHITYWXAAAD-UHFFFAOYSA-N
Mol Weight 446.44 g/mol
Molecular Formula C21H14N6O4S
Exact Mass 446.079724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 1EQqWSezqBK
Name 4-AMINO-4'-BENZYL-2,7-DINITRO-4',5'-DIHYDROSPIRO-[FLUOREN-9,3'-(1,2,4-TRIAZOLE)]-5'-THIONE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H14N6O4S
InChI InChI=1S/C21H14N6O4S/c22-18-10-14(27(30)31)9-17-19(18)15-7-6-13(26(28)29)8-16(15)21(17)24-23-20(32)25(21)11-12-4-2-1-3-5-12/h1-10H,11,22H2
InChIKey LPFWHITYWXAAAD-UHFFFAOYSA-N
Literature Reference Author A.A.HASSAN,Y.R.IBRAHIM,A.M.SHAWKY,D.DOEPP
Literature Reference Citation J.HETCYCL.CHEM.,43,849(2006)
Literature Reference DOI 10.1002/jhet.5570430406
Molecular Weight 446.440 g/mol
Sample ID 67514
Solvent DMSO-D6