| SpectraBase Spectrum ID |
3FSP1P7bzs8 |
| Name |
2,3-Dipentyl-7-methoxyindenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.208930140 u |
| Formula |
C20H28O2 |
| InChI |
InChI=1S/C20H28O2/c1-4-6-8-11-15-16-13-10-14-18(22-3)19(16)20(21)17(15)12-9-7-5-2/h10,13-14H,4-9,11-12H2,1-3H3 |
| InChIKey |
VFQNGZUWGDTFBV-UHFFFAOYSA-N |
| SMILES |
C1(C(=C(CCCCC)C2=C1C(OC)=CC=C2)CCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943201 |
