SpectraBase Spectrum ID |
CxU9kJ2i6g5 |
Name |
Ethanol, 1,1'-(9,10-anthracenediylidene)bis-, diacetate, (Z)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
348.136159120 u |
Formula |
C22H20O4 |
InChI |
InChI=1S/C22H20O4/c1-13(25-15(3)23)21-17-9-5-7-11-19(17)22(14(2)26-16(4)24)20-12-8-6-10-18(20)21/h5-12H,1-4H3/b21-13-,22-14- |
InChIKey |
VBNGJYCRAAWDNY-JZTLMNBPSA-N |
Molecular Weight |
348.398 g/mol |
SMILES |
C1=2\C(C=3C(\C(C2C=CC=C1)=C\(OC(=O)C)C)=CC=CC3)=C\(OC(=O)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872258 |