| SpectraBase Spectrum ID |
Bj4NBqwCvZM |
| Name |
1-Bromo-8-ethyl-7,9-dimethylbenzopyrromethylene hydrobromide |
| Alternate Name(s) |
(1E)-3-bromo-1-[(4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)methylene]-1H-isoindolium bromide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18Br2N2 |
| InChI |
InChI=1S/C17H17BrN2.BrH/c1-4-12-10(2)15(19-11(12)3)9-16-13-7-5-6-8-14(13)17(18)20-16;/h5-9,19H,4H2,1-3H3;1H/b16-9+; |
| InChIKey |
XJWBSDZUCKPAEA-QOVZSLTQSA-N |
| Molecular Weight |
410.153 g/mol |
| SMILES |
[Br-].[NH+]1=C(c2ccccc2\C1=C\c1[nH]c(c(c1C)CC)C)Br |
| SPLASH |
splash10-0059-0009000000-47dc551d6565a33bdee5 |
| Source of Spectrum |
KC-0-2464-6 |
| Wiley ID |
786604 |
