| SpectraBase Spectrum ID |
GLGewmII0Pn |
| Name |
6H-Dibenzo[B,D]pyran-1,9-diol, 6A,9,10,10A-tetrahydro-6,6,9-trimethyl-3-pentyl-, [6ar-(6A.alpha.,9.beta.,10A.beta.)]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
330.219494823 u |
| Formula |
C21H30O3 |
| InChI |
InChI=1S/C21H30O3/c1-5-6-7-8-14-11-17(22)19-15-13-21(4,23)10-9-16(15)20(2,3)24-18(19)12-14/h9-12,15-16,22-23H,5-8,13H2,1-4H3 |
| InChIKey |
PGZISGZFEFJPOZ-UHFFFAOYSA-N |
| Molecular Weight |
330.468 g/mol |
| SMILES |
C1(O)=C2C3C(C(OC2=CC(=C1)CCCCC)(C)C)C=CC(C3)(C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912085 |
![6H-Dibenzo[b,d]pyran-1,9-diol, 6a,9,10,10a-tetrahydro-6,6,9-trimethyl-3-pentyl-, [6aR-(6a.alpha.,9.beta.,10a.beta.)]-](/api/spectrum/GLGewmII0Pn/structure.png?h=300&w=458 "6H-Dibenzo[b,d]pyran-1,9-diol, 6a,9,10,10a-tetrahydro-6,6,9-trimethyl-3-pentyl-, [6aR-(6a.alpha.,9.beta.,10a.beta.)]-")
