| SpectraBase Spectrum ID |
GaMSXBanXh7 |
| Name |
6-(N-Pentyl)oxy-4-methylcoumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.125594437 u |
| Formula |
C15H18O3 |
| InChI |
InChI=1S/C15H18O3/c1-3-4-5-8-17-12-6-7-14-13(10-12)11(2)9-15(16)18-14/h6-7,9-10H,3-5,8H2,1-2H3 |
| InChIKey |
GZIVVJBWYIBEDA-UHFFFAOYSA-N |
| Molecular Weight |
246.306 g/mol |
| SMILES |
C1=C(C=C2C(=C1)OC(=O)C=C2C)OCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909694 |
