| SpectraBase Spectrum ID |
3uPuLf7BCa4 |
| Name |
4-((5S,6S,9R)-6-Isopropyl-4,9-dimethyl-1,3-dioxaspiro[4.5]decan-2-yl)-2-methoxyphenol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.214409442 u |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-12(2)16-8-6-13(3)11-20(16)14(4)23-19(24-20)15-7-9-17(21)18(10-15)22-5/h7,9-10,12-14,16,19,21H,6,8,11H2,1-5H3/t13-,14?,16+,19?,20-/m1/s1 |
| InChIKey |
HZKLDBRQERCCHT-UZVHKFPESA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
C1=CC(=CC(OC)=C1O)C1O[C@]2(C(O1)C)[C@@](CC[C@](C2)(C)[H])(C(C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.815816 |
![4-((5S,6S,9R)-6-Isopropyl-4,9-dimethyl-1,3-dioxaspiro[4.5]decan-2-yl)-2-methoxyphenol](/api/spectrum/3uPuLf7BCa4/structure.png?h=300&w=458 "4-((5S,6S,9R)-6-Isopropyl-4,9-dimethyl-1,3-dioxaspiro[4.5]decan-2-yl)-2-methoxyphenol")
