| SpectraBase Spectrum ID |
4OTVPzI0KRK |
| Name |
6-Hydroperoxide-6-phenyl-5-carboxyethyl-2,3-dihydro-6H-pyran |
| CAS Registry Number |
129000-60-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H16O5 |
| InChI |
InChI=1S/C14H16O5/c15-13(16)9-8-12-7-4-10-18-14(12,19-17)11-5-2-1-3-6-11/h1-3,5-7,17H,4,8-10H2,(H,15,16) |
| InChIKey |
ITCUOFLQNDJDOM-UHFFFAOYSA-N |
| Molecular Weight |
264.277 g/mol |
| SMILES |
OC(CCC=1C(OO)(OCCC1)c1ccccc1)=O |
| SPLASH |
splash10-001i-0090000000-dccfc338169b646682e5 |
| Source of Spectrum |
J-55-5504-3 |
| Synonyms |
3-(2-hydroperoxy-2-phenyl-5,6-dihydro-2H-pyran-3-yl)propanoic acid |
| Wiley ID |
1267790 |
