SpectraBase Spectrum ID |
1e0TXVkOh6H |
Name |
1H-1,2,3-triazole-4-carboxylic acid, 1-[4-[[[[4-[4-(ethoxycarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-yl]amino]methyl]amino]-1,2,5- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
488.162876406 u |
Formula |
C17H20N12O6 |
InChI |
InChI=1S/C17H20N12O6/c1-5-32-16(30)10-8(3)28(26-20-10)14-12(22-34-24-14)18-7-19-13-15(25-35-23-13)29-9(4)11(21-27-29)17(31)33-6-2/h5-7H2,1-4H3,(H,18,22)(H,19,23) |
InChIKey |
RFMIGBYXVBNCBY-UHFFFAOYSA-N |
Molecular Weight |
488.425 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14367 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10310394; Lab Info: VUR; Lab Number: VUR-0002198 |