SpectraBase Spectrum ID |
13oa7AzdNDu |
Name |
(Z)-2-(Heptadec-10-en-1-yl)-4,5-dihydro-1H-imidazole |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
306.303499232 u |
Formula |
C20H38N2 |
InChI |
InChI=1S/C20H38N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-21-18-19-22-20/h7-8H,2-6,9-19H2,1H3,(H,21,22)/b8-7- |
InChIKey |
XKRIQPZSCIVKOU-FPLPWBNLSA-N |
Molecular Weight |
306.538 g/mol |
SMILES |
C1(=NCCN1)CCCCCCCCC\C=C/CCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931068 |