| SpectraBase Spectrum ID |
D5om15x06NB |
| Name |
(5S-Acetoxy-3R-tigloxy-7-hydroxy)-(p-menth-6-en-2-one, (S)), ac derivative |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.167853170 u |
| Formula |
C19H26O7 |
| InChI |
InChI=1S/C19H26O7/c1-7-11(4)19(23)26-18-16(10(2)3)15(25-13(6)21)8-14(17(18)22)9-24-12(5)20/h7-8,10,15-16,18H,9H2,1-6H3/b11-7+/t15-,16-,18+/m0/s1 |
| InChIKey |
NDEWIHOPYNBTCF-FCOHEEAHSA-N |
| Molecular Weight |
366.410 g/mol |
| SMILES |
CC(=O)O[C@]1(C=C(C(=O)[C@](OC(\C(=C\C)C)=O)([C@]1(C(C)C)[H])[H])COC(C)=O)[H] |
