| SpectraBase Spectrum ID |
AgWANcyJC9D |
| Name |
1-{6-[(1E,3E)-4-(5-methyl-2H-[1,2,3]triazol-4-yl)-1,3-butadienyl]-2-pyridyl}ethyl acetate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.142975834 u |
| Formula |
C16H18N4O2 |
| InChI |
InChI=1S/C16H18N4O2/c1-11-15(19-20-18-11)9-5-4-7-14-8-6-10-16(17-14)12(2)22-13(3)21/h4-10,12H,1-3H3,(H,18,19,20)/b7-4+,9-5+ |
| InChIKey |
JOFGFWIIBVGEFN-XCIOYXGDSA-N |
| Instrument Name |
Fisons VG Autospec Trio 1000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0003.613 |
| Quality |
184 |
| SMILES |
N1N=C(C(=N1)\C=C\C=C\C1=CC=CC(=N1)C(C)OC(C)=O)C |
| SPLASH |
splash10-0pb9-0790000000-2c7cd8dafc09976b4160 |
| Source of Spectrum |
ARK-2002-150-9b (DOI: 10.3998/ark.5550190.0003.613) |
| Wiley ID |
1904723 |
![1-{6-[(1E,3E)-4-(5-methyl-2H-[1,2,3]triazol-4-yl)-1,3-butadienyl]-2-pyridyl}ethyl acetate](/api/spectrum/AgWANcyJC9D/structure.png?h=300&w=458 "1-{6-[(1E,3E)-4-(5-methyl-2H-[1,2,3]triazol-4-yl)-1,3-butadienyl]-2-pyridyl}ethyl acetate")
