| SpectraBase Spectrum ID |
FAwMsFRSYWr |
| Name |
(4-Chlorophenyl)[3-(3,4, 5-trimethoxyphenyl)oxiran-2-yl]methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.076451342 u |
| Formula |
C18H17ClO5 |
| InChI |
InChI=1S/C18H17ClO5/c1-21-13-8-11(9-14(22-2)17(13)23-3)16-18(24-16)15(20)10-4-6-12(19)7-5-10/h4-9,16,18H,1-3H3 |
| InChIKey |
BBHDQABELKBJSM-UHFFFAOYSA-N |
| Molecular Weight |
348.782 g/mol |
| SMILES |
C1(OC1C=1C=C(OC)C(=C(C1)OC)OC)C(C=1C=CC(=CC1)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961502 |
![(4-Chlorophenyl)[3-(3,4, 5-trimethoxyphenyl)oxiran-2-yl]methanone](/api/spectrum/FAwMsFRSYWr/structure.png?h=300&w=458 "(4-Chlorophenyl)[3-(3,4, 5-trimethoxyphenyl)oxiran-2-yl]methanone")
