| SpectraBase Spectrum ID |
KxUKIRqQ1mw |
| Name |
4,8,12-Tetradecatrien-1-one, 2-chloro-1-(2-hydroxyphenyl)-5,9,13-trimethyl-, (E,E)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.201257936 u |
| Formula |
C23H31ClO2 |
| InChI |
InChI=1S/C23H31ClO2/c1-17(2)9-7-10-18(3)11-8-12-19(4)15-16-21(24)23(26)20-13-5-6-14-22(20)25/h5-6,9,11,13-15,21,25H,7-8,10,12,16H2,1-4H3/b18-11+,19-15+ |
| InChIKey |
ZBRDZHBGJAXWQH-CFBAGHHKSA-N |
| Molecular Weight |
374.952 g/mol |
| SMILES |
C=1(C(=O)C(C\C=C\(CC\C=C\(CCC=C(C)C)C)C)Cl)C(O)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964534 |
