| SpectraBase Spectrum ID |
AX5E98VXbBu |
| Name |
3-methyl-BbF |
| CAS Registry Number |
95741-50-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H14 |
| InChI |
InChI=1S/C21H14/c1-13-10-11-18-15-7-3-2-6-14(15)12-19-16-8-4-5-9-17(16)20(13)21(18)19/h2-12H,1H3 |
| InChIKey |
RTQQCRRPYSNANT-UHFFFAOYSA-N |
| Molecular Weight |
266.343 g/mol |
| SMILES |
c12c3-c4ccccc4-c2c(C)ccc1c1c(cccc1)c3 |
| SPLASH |
splash10-000o-0090000000-dd89e2e48dfe23f0976d |
| Source of Spectrum |
J-50-1953-9 |
| Synonyms |
3-Methylbenzo[e]acephenanthrylene |
| Wiley ID |
1270832 |
