| SpectraBase Spectrum ID |
25PFyBUQPSm |
| Name |
6-Bromo-N-methoxymethyl-3'-deimino-3'-oxoaplysinopsin |
| Alternate Name(s) |
(5E)-5-{[6-bromo-1-(methoxymethyl)-1H-indol-3-yl]methylene}-1,3-dimethyl-2,4-imidazolidinedione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16BrN3O3 |
| InChI |
InChI=1S/C16H16BrN3O3/c1-18-14(15(21)19(2)16(18)22)6-10-8-20(9-23-3)13-7-11(17)4-5-12(10)13/h4-8H,9H2,1-3H3/b14-6+ |
| InChIKey |
SCKSOPYKIHAPGL-MKMNVTDBSA-N |
| Molecular Weight |
378.226 g/mol |
| SMILES |
C1(N(C(\C(N1C)=C/c1c[n](COC)c2c1ccc(Br)c2)=O)C)=O |
| SPLASH |
splash10-0002-9008000000-8855f701bdee9fdeaf02 |
| Source of Spectrum |
F-50-2253-31 |
| Wiley ID |
1358176 |
