SpectraBase Spectrum ID |
FyCl10mWpo4 |
Name |
Arachidamide, N-(2-pentyl)-N-(3-methylbutyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
451.475315587 u |
Formula |
C30H61NO |
InChI |
InChI=1S/C30H61NO/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-30(32)31(27-26-28(3)4)29(5)24-7-2/h28-29H,6-27H2,1-5H3 |
InChIKey |
NTELHEJVJOSXCT-UHFFFAOYSA-N |
Molecular Weight |
451.824 g/mol |
SMILES |
CCCC(N(C(=O)CCCCCCCCCCCCCCCCCCC)CCC(C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.811648 |