| SpectraBase Spectrum ID |
5ozsMFt5eD8 |
| Name |
3-Acetoxy-2-(methoxycarbonyl)-1-methyl-5-phenyl-9-oxabicyclo[3.3.1]non-2-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
330.146723803 u |
| Formula |
C19H22O5 |
| InChI |
InChI=1S/C19H22O5/c1-13(20)23-15-12-19(14-8-5-4-6-9-14)11-7-10-18(2,24-19)16(15)17(21)22-3/h4-6,8-9H,7,10-12H2,1-3H3 |
| InChIKey |
BJMUQJORSNJRRY-UHFFFAOYSA-N |
| Molecular Weight |
330.380 g/mol |
| SMILES |
C=1(C2(OC(CC1OC(=O)C)(C=1C=CC=CC1)CCC2)C)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.843307 |
![3-Acetoxy-2-(methoxycarbonyl)-1-methyl-5-phenyl-9-oxabicyclo[3.3.1]non-2-ene](/api/spectrum/5ozsMFt5eD8/structure.png?h=300&w=458 "3-Acetoxy-2-(methoxycarbonyl)-1-methyl-5-phenyl-9-oxabicyclo[3.3.1]non-2-ene")
