| SpectraBase Spectrum ID |
HP9wVwaSxzm |
| Name |
(3as,5R,7ar)-5-(1,1-Dimethylpropyl)octahydro-7A-methyl-1-benzofuran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.198365456 u |
| Formula |
C14H26O |
| InChI |
InChI=1S/C14H26O/c1-5-13(2,3)11-6-8-14(4)12(10-11)7-9-15-14/h11-12H,5-10H2,1-4H3/t11-,12-,14-/m1/s1 |
| InChIKey |
NDPOUNKBITXIFM-YRGRVCCFSA-N |
| Molecular Weight |
210.361 g/mol |
| SMILES |
C1[C@@](CC[C@@]2([C@@]1(CCO2)[H])C)(C(CC)(C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927457 |
