| SpectraBase Spectrum ID |
AUvuSZQTmHZ |
| Name |
6,7,8,9,10,11-Hexahydro-1,5-pentanocycloocta[D]oxepine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.182715392 u |
| Formula |
C17H24O |
| InChI |
InChI=1S/C17H24O/c1-2-7-11-17-15-9-5-3-4-8-14(12-18-13-15)16(17)10-6-1/h12-13H,1-11H2 |
| InChIKey |
GCVZBJVCVGDULL-UHFFFAOYSA-N |
| Molecular Weight |
244.378 g/mol |
| SMILES |
C12=C(C3=COC=C2CCCCC3)CCCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95798 |
![6,7,8,9,10,11-Hexahydro-1,5-pentanocycloocta[D]oxepine](/api/spectrum/AUvuSZQTmHZ/structure.png?h=300&w=458 "6,7,8,9,10,11-Hexahydro-1,5-pentanocycloocta[D]oxepine")
