| SpectraBase Spectrum ID |
HpRvD0BAmJl |
| Name |
(R)-(-)-3-acetoxy-4-benzyl-5-methyl-2(5H)-furanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.089208927 u |
| Formula |
C14H14O4 |
| InChI |
InChI=1S/C14H14O4/c1-9-12(8-11-6-4-3-5-7-11)13(14(16)17-9)18-10(2)15/h3-7,9H,8H2,1-2H3/t9-/m1/s1 |
| InChIKey |
MTNCFWXDCAHIPI-SECBINFHSA-N |
| Molecular Weight |
246.262 g/mol |
| SMILES |
C1(=C([C@@](C)(OC1=O)[H])CC=1C=CC=CC1)OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95172 |
