| SpectraBase Spectrum ID |
IhJGKI1MKHW |
| Name |
Methyl 6-anisoyl-.beta.-D-galactopyranoside |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.115817596 u |
| Formula |
C15H20O8 |
| InChI |
InChI=1S/C15H20O8/c1-20-9-5-3-8(4-6-9)14(19)22-7-10-11(16)12(17)13(18)15(21-2)23-10/h3-6,10-13,15-18H,7H2,1-2H3/t10-,11+,12+,13-,15-/m1/s1 |
| InChIKey |
MUTHLFHTKCVJJZ-NLRWUALESA-N |
| Molecular Weight |
328.317 g/mol |
| SMILES |
[C@]1([C@](O[C@]([C@@]([C@]1(O)[H])(O)[H])(OC)[H])(COC(=O)C1=CC=C(C=C1)OC)[H])(O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.831321 |
