| SpectraBase Spectrum ID |
6eqfZQuRf7x |
| Name |
2',3',4',-tri(N-Pentyl)oxyacetophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.277009700 u |
| Formula |
C23H38O4 |
| InChI |
InChI=1S/C23H38O4/c1-5-8-11-16-25-21-15-14-20(19(4)24)22(26-17-12-9-6-2)23(21)27-18-13-10-7-3/h14-15H,5-13,16-18H2,1-4H3 |
| InChIKey |
XRJTWXMFNORFKI-UHFFFAOYSA-N |
| Molecular Weight |
378.553 g/mol |
| SMILES |
C1=CC(C(C)=O)=C(C(=C1OCCCCC)OCCCCC)OCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847211 |
