SpectraBase Spectrum ID |
40djT4jra7K |
Name |
1-(Cyclopropacyclododecan-1-ylidene)cyclopropacyclododecane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
356.344301417 u |
Formula |
C26H44 |
InChI |
InChI=1S/C26H44/c1-2-6-10-14-18-22-21(17-13-9-5-1)25(22)26-23-19-15-11-7-3-4-8-12-16-20-24(23)26/h21-24H,1-20H2 |
InChIKey |
SIQVTQCLJGYWDN-UHFFFAOYSA-N |
Molecular Weight |
356.638 g/mol |
SMILES |
C1CCCCC2C(C2CCCCC1)=C1C2CCCCCCCCCCC12 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91671 |