| SpectraBase Spectrum ID |
96MqhuIMttl |
| Name |
Benz(A)anthracene, 6,8-dimethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
256.125200515 u |
| Formula |
C20H16 |
| InChI |
InChI=1S/C20H16/c1-13-6-5-8-16-11-20-17-9-4-3-7-15(17)10-14(2)19(20)12-18(13)16/h3-12H,1-2H3 |
| InChIKey |
OVSHSQPYUKVYOB-UHFFFAOYSA-N |
| Molecular Weight |
256.348 g/mol |
| SMILES |
C1=C(C2=C(C=C1)C=C1C(=C2)C(=CC2=C1C=CC=C2)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939468 |
