SpectraBase Spectrum ID |
BIHKYdOgWY0 |
Name |
Arachidamide, N-(2-pentyl)-N-butyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
437.459665523 u |
Formula |
C29H59NO |
InChI |
InChI=1S/C29H59NO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-29(31)30(27-9-6-2)28(4)25-7-3/h28H,5-27H2,1-4H3 |
InChIKey |
WYPAARYTABRHHP-UHFFFAOYSA-N |
Molecular Weight |
437.797 g/mol |
SMILES |
CCCC(N(C(=O)CCCCCCCCCCCCCCCCCCC)CCCC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886811 |