| SpectraBase Spectrum ID |
GZ1DE6sCrdq |
| Name |
6,7,8,9,10,11,12,13,14,15-Decahydro-1,5-hexanocyclododeca[D]oxepine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.260965714 u |
| Formula |
C22H34O |
| InChI |
InChI=1S/C22H34O/c1-2-4-6-12-16-22-20-14-10-8-7-9-13-19(17-23-18-20)21(22)15-11-5-3-1/h17-18H,1-16H2 |
| InChIKey |
KEWGFGMIENMXPP-UHFFFAOYSA-N |
| Molecular Weight |
314.513 g/mol |
| SMILES |
C12=C(C3=COC=C2CCCCCC3)CCCCCCCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944617 |
![6,7,8,9,10,11,12,13,14,15-Decahydro-1,5-hexanocyclododeca[D]oxepine](/api/spectrum/GZ1DE6sCrdq/structure.png?h=300&w=458 "6,7,8,9,10,11,12,13,14,15-Decahydro-1,5-hexanocyclododeca[D]oxepine")
