| SpectraBase Spectrum ID |
7mA0ANCDxzE |
| Name |
(Z)-3-Methoxy-1-[(methoxycarbonyl)methylene]-3-phenyl-1,3-dihydroisobenzofuran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
296.104858991 u |
| Formula |
C18H16O4 |
| InChI |
InChI=1S/C18H16O4/c1-20-17(19)12-16-14-10-6-7-11-15(14)18(21-2,22-16)13-8-4-3-5-9-13/h3-12H,1-2H3/b16-12- |
| InChIKey |
GSLYLAKWWZCBJM-VBKFSLOCSA-N |
| SMILES |
C1(O\C(C=2C=CC=CC12)=C\C(=O)OC)(C=1C=CC=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871585 |
![(Z)-3-Methoxy-1-[(methoxycarbonyl)methylene]-3-phenyl-1,3-dihydroisobenzofuran](/api/spectrum/7mA0ANCDxzE/structure.png?h=300&w=458 "(Z)-3-Methoxy-1-[(methoxycarbonyl)methylene]-3-phenyl-1,3-dihydroisobenzofuran")
