| SpectraBase Spectrum ID |
CEXnLawPIY4 |
| Name |
2H-3,5A-Epoxynaphth[2,1-B]oxepin, dodecahydro-3,8,8,11A-tetramethyl-, [3R-(3.alpha.,5A.alpha.,7A.beta.,11A.alpha.,11B.beta.)]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
278.224580204 u |
| Formula |
C18H30O2 |
| InChI |
InChI=1S/C18H30O2/c1-15(2)8-5-9-17(4)13(15)7-11-18-14(17)6-10-16(3,20-18)12-19-18/h13-14H,5-12H2,1-4H3 |
| InChIKey |
OXWMPEIBPHMNEA-UHFFFAOYSA-N |
| SMILES |
C12C(CCCC2(C2C3(CC1)OC(C)(CC2)CO3)C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818279 |
![2H-3,5a-Epoxynaphth[2,1-b]oxepin, dodecahydro-3,8,8,11a-tetramethyl-, [3R-(3.alpha.,5a.alpha.,7a.beta.,11a.alpha.,11b.beta.)]-](/api/spectrum/CEXnLawPIY4/structure.png?h=300&w=458 "2H-3,5a-Epoxynaphth[2,1-b]oxepin, dodecahydro-3,8,8,11a-tetramethyl-, [3R-(3.alpha.,5a.alpha.,7a.beta.,11a.alpha.,11b.beta.)]-")
