| SpectraBase Spectrum ID |
ERu1rDRnd17 |
| Name |
Hexyl (E)-p-coumarate |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
248.141244501 u |
| Formula |
C15H20O3 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C15H20O3/c1-2-3-4-5-12-18-15(17)11-8-13-6-9-14(16)10-7-13/h6-11,16H,2-5,12H2,1H3/b11-8+ |
| InChIKey |
AGXFGQBFMFJFCD-DHZHZOJOSA-N |
| Molecular Weight |
248.322 g/mol |
| Nominal Mass |
248 u |
| Number of Peaks |
39 |
| SMILES |
Oc1ccc(cc1)\C=C\C(=O)OCCCCCC |
| SPLASH |
splash10-03dj-2900000000-50315797bbd8c8a3d8fd |
| Source |
L. Wroblewski |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI001017 |
