Systematic / IUPAC Name: (2S,3R)-3-Hydroxy-4-methoxy-2-(2-phenylethyl)-2,3-dihydropyran-6-one
ID: Reference7761
Other Names: 2H-Pyran-2-one, 5,6-dihydro-5-hydroxy-4-methoxy-6-(2-phenylethyl)-, (5R,6S)-
Formula: C14H16O4
(5R,6S)-5-Hydroxy-4-methoxy-6-(2-phenylethyl)-5,6-dihydro-2H-pyran-2-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
| No. of Spectral Trees | 1 |
| No. of Spectra | 162 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 4/12/2018 2:41:10 PM |
| InChI | InChI=1S/C14H16O4/c1-17-12-9-13(15)18-11(14(12)16)8-7-10-5-3-2-4-6-10/h2-6,9,11,14,16H,7-8H2,1H3/t11-,14+/m0/s1 |
| InChI Key | VJCNEDVMYQCMBK-SMDDNHRTSA-N |
| Canonical SMILES | COC1=CC(=O)OC(C1O)CCC2=CC=CC=C2 |
| CAS | |
| Splash | |
| Other Names | 2H-Pyran-2-one, 5,6-dihydro-5-hydroxy-4-methoxy-6-(2-phenylethyl)-, (5R,6S)- |