| SpectraBase Spectrum ID |
1MJCEhqpVPc |
| Name |
(2E,11E)-12-(Benzo[1,3]dioxol-5-yl)-N-(2-methylpropyl)dodeca-2,11-dienamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
371.246043924 u |
| Formula |
C23H33NO3 |
| InChI |
InChI=1S/C23H33NO3/c1-19(2)17-24-23(25)13-11-9-7-5-3-4-6-8-10-12-20-14-15-21-22(16-20)27-18-26-21/h10-16,19H,3-9,17-18H2,1-2H3,(H,24,25)/b12-10+,13-11+ |
| InChIKey |
DBXHHZYPPITMCW-DCIPZJNNSA-N |
| Molecular Weight |
371.521 g/mol |
| SMILES |
C(\C=C\CCCCCCC\C=C\C=1C=C2OCOC2=CC1)(=O)NCC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9651 |
![(2E,11E)-12-(Benzo[1,3]dioxol-5-yl)-N-(2-methylpropyl)dodeca-2,11-dienamide](/api/spectrum/1MJCEhqpVPc/structure.png?h=300&w=458 "(2E,11E)-12-(Benzo[1,3]dioxol-5-yl)-N-(2-methylpropyl)dodeca-2,11-dienamide")
