| SpectraBase Spectrum ID |
2E05xzwNqoa |
| Name |
4-Isopropylidene-2-anti-methoxyadamantane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
206.167065327 u |
| Formula |
C14H22O |
| InChI |
InChI=1S/C14H22O/c1-8(2)13-10-4-9-5-11(7-10)14(15-3)12(13)6-9/h9-12,14H,4-7H2,1-3H3/t9-,10+,11-,12-,14+/m0/s1 |
| InChIKey |
FOPOXPBTZCNXTR-XJBAAKRRSA-N |
| Molecular Weight |
206.329 g/mol |
| SMILES |
C1([C@]2([C@](OC)([C@@]3(C[C@]1(C[C@@](C3)(C2)[H])[H])[H])[H])[H])=C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914382 |
