SpectraBase Spectrum ID |
6985dlNRpbD |
Name |
1-Benzyl-5-iodo-3-methoxy-2(1H)-pyrazinone |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H11IN2O2 |
InChI |
InChI=1S/C12H11IN2O2/c1-17-11-12(16)15(8-10(13)14-11)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3 |
InChIKey |
XQOVZOJWMXQYOG-UHFFFAOYSA-N |
Molecular Weight |
342.136 g/mol |
SMILES |
C1(C(=NC(=CN1Cc1ccccc1)I)OC)=O |
SPLASH |
splash10-0006-9004000000-c67b70c1cc3e27a631ae |
Source of Spectrum |
KC-61-3959-12 |
Wiley ID |
1628707 |