| SpectraBase Spectrum ID |
2hEssJLUy9R |
| Name |
4-(Hydroxymethyl)-3,4A,8,8-tetramethyl-1,2,5,6,7,8A-hexahydronaphthalene-1,2-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
254.188194694 u |
| Formula |
C15H26O3 |
| InChI |
InChI=1S/C15H26O3/c1-9-10(8-16)15(4)7-5-6-14(2,3)13(15)12(18)11(9)17/h11-13,16-18H,5-8H2,1-4H3 |
| InChIKey |
SQUSSQHYJYXURV-UHFFFAOYSA-N |
| Molecular Weight |
254.370 g/mol |
| SMILES |
C(O)C1=C(C)C(O)C(O)C2C1(C)CCCC2(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910716 |
