| SpectraBase Spectrum ID |
GTeqvMSWS1k |
| Name |
1,10-Phenanthrenediol, diacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.089208927 u |
| Formula |
C18H14O4 |
| InChI |
InChI=1S/C18H14O4/c1-11(19)21-16-9-5-8-15-14-7-4-3-6-13(14)10-17(18(15)16)22-12(2)20/h3-10H,1-2H3 |
| InChIKey |
HTGLRETYEVWRQX-UHFFFAOYSA-N |
| Molecular Weight |
294.306 g/mol |
| SMILES |
C=12C(C3=CC=CC=C3C=C2OC(=O)C)=CC=CC1OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839174 |
