SpectraBase Spectrum ID |
8Gc2C1scR5K |
Name |
[1,2,4]Triazolo[1,5-a]pyrimidinium, 1,2-dihydro-5,7-dimethyl-2-oxo-3-[3-(phenylmethoxy)propyl]-, hydroxide, inner salt |
CAS Registry Number |
126085-75-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H20N4O2 |
InChI |
InChI=1S/C17H20N4O2/c1-13-11-14(2)21-16(18-13)20(17(22)19-21)9-6-10-23-12-15-7-4-3-5-8-15/h3-5,7-8,11H,6,9-10,12H2,1-2H3 |
InChIKey |
KVZRVKBPYIKSPJ-UHFFFAOYSA-N |
Molecular Weight |
312.373 g/mol |
SMILES |
c12[n+](nc([n]2CCCOCc2ccccc2)[O-])c(cc(n1)C)C |
SPLASH |
splash10-0i90-0910000000-204ed39f1eac2aef505e |
Source of Spectrum |
KC-1989-1731-3 |
Synonyms |
1-[3-(benzyloxy)propyl]-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-4-ium-2-olate
3-(3-Benzyloxypropyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyri-midinium-2-olate |
Wiley ID |
1313254 |