SpectraBase Spectrum ID |
D7IPAI8U4qt |
Name |
5-Hydroxy-pentanoic acid, [5-(5-hydroxy-pentanoylamino)-pentyl]-amide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
302.220557450 u |
Formula |
C15H30N2O4 |
InChI |
InChI=1S/C15H30N2O4/c18-12-6-2-8-14(20)16-10-4-1-5-11-17-15(21)9-3-7-13-19/h18-19H,1-13H2,(H,16,20)(H,17,21) |
InChIKey |
SHVPVZOKQSGUID-UHFFFAOYSA-N |
SMILES |
C(O)CCCC(NCCCCCNC(CCCCO)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971859 |