| SpectraBase Spectrum ID |
1SVY1U9prld |
| Name |
3-(4-Fluorophenyl)-9-phenyl-4-propyl-1,6-dioxaspiro[4.4]non-3-en-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.147472696 u |
| Formula |
C22H21FO3 |
| InChI |
InChI=1S/C22H21FO3/c1-2-6-19-20(16-9-11-17(23)12-10-16)21(24)26-22(19)18(13-14-25-22)15-7-4-3-5-8-15/h3-5,7-12,18H,2,6,13-14H2,1H3 |
| InChIKey |
UGFCRAMUFCQNTB-UHFFFAOYSA-N |
| Molecular Weight |
352.405 g/mol |
| SMILES |
C1(OC2(C(=C1C=1C=CC(=CC1)F)CCC)OCCC2C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.884751 |
![3-(4-Fluorophenyl)-9-phenyl-4-propyl-1,6-dioxaspiro[4.4]non-3-en-2-one](/api/spectrum/1SVY1U9prld/structure.png?h=300&w=458 "3-(4-Fluorophenyl)-9-phenyl-4-propyl-1,6-dioxaspiro[4.4]non-3-en-2-one")
