| SpectraBase Spectrum ID |
2cxLAPAPO4 |
| Name |
1-(N,N-Dipropylaminomethyl)cyclobutabenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
217.183049745 u |
| Formula |
C15H23N |
| InChI |
InChI=1S/C15H23N/c1-3-9-16(10-4-2)12-14-11-13-7-5-6-8-15(13)14/h5-8,14H,3-4,9-12H2,1-2H3 |
| InChIKey |
UQIMTSZMWMZMKU-UHFFFAOYSA-N |
| Molecular Weight |
217.356 g/mol |
| SMILES |
C=12C(CC2=CC=CC1)CN(CCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964623 |
