| SpectraBase Spectrum ID |
H7B0Og58gTz |
| Name |
1,3-Ditert-butyl-7-methyl-benzo[C]phenanthrene-5,6-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.208930140 u |
| Formula |
C27H28O2 |
| InChI |
InChI=1S/C27H28O2/c1-15-12-16-10-8-9-11-18(16)23-21(15)25(29)24(28)19-13-17(26(2,3)4)14-20(22(19)23)27(5,6)7/h8-14H,1-7H3 |
| InChIKey |
YSYOTYLHTLNFHD-UHFFFAOYSA-N |
| Molecular Weight |
384.519 g/mol |
| SMILES |
C=12C(C(=O)C(C=3C2=C2C(=CC3C)C=CC=C2)=O)=CC(=CC1C(C)(C)C)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895166 |
![1,3-Ditert-butyl-7-methyl-benzo[c]phenanthrene-5,6-dione](/api/spectrum/H7B0Og58gTz/structure.png?h=300&w=458 "1,3-Ditert-butyl-7-methyl-benzo[c]phenanthrene-5,6-dione")
