| SpectraBase Spectrum ID |
2DTLw8Iviyq |
| Name |
4-Acetoxymethyl-5-[2-(2-iodoethyl)phenyl]tetrahydrofuran-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.017154023 u |
| Formula |
C15H17IO4 |
| InChI |
InChI=1S/C15H17IO4/c1-10(17)19-9-12-8-14(18)20-15(12)13-5-3-2-4-11(13)6-7-16/h2-5,12,15H,6-9H2,1H3/t12-,15-/m0/s1 |
| InChIKey |
NEIPGSGSCIGGML-WFASDCNBSA-N |
| Molecular Weight |
388.201 g/mol |
| SMILES |
[C@]1(OC(=O)C[C@]1(COC(=O)C)[H])(C=1C(CCI)=CC=CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936234 |
![4-Acetoxymethyl-5-[2-(2-iodoethyl)phenyl]tetrahydrofuran-2-one](/api/spectrum/2DTLw8Iviyq/structure.png?h=300&w=458 "4-Acetoxymethyl-5-[2-(2-iodoethyl)phenyl]tetrahydrofuran-2-one")
