| SpectraBase Spectrum ID |
Bw7l9wFzufs |
| Name |
9(10H)-Anthracenone, 10-hydroxy-3,10-bis(1-methylpropyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.193280075 u |
| Formula |
C22H26O2 |
| InChI |
InChI=1S/C22H26O2/c1-5-14(3)16-11-12-18-20(13-16)22(24,15(4)6-2)19-10-8-7-9-17(19)21(18)23/h7-15,24H,5-6H2,1-4H3 |
| InChIKey |
WXDIURKMKLPVNY-UHFFFAOYSA-N |
| Molecular Weight |
322.448 g/mol |
| SMILES |
C=12C(C=3C=CC=CC3C(C2=CC=C(C1)C(CC)C)=O)(C(CC)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905861 |
