SpectraBase Spectrum ID |
CdIfvHkMIHi |
Name |
(2Z,4Z)-2,5-bis(Morpholin-4-ylmethyl)hexa-2,4-dien-1,6-diol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
312.204907386 u |
Formula |
C16H28N2O4 |
InChI |
InChI=1S/C16H28N2O4/c19-13-15(11-17-3-7-21-8-4-17)1-2-16(14-20)12-18-5-9-22-10-6-18/h1-2,19-20H,3-14H2/b15-1-,16-2- |
InChIKey |
XPSCKBQJJGSNBS-PRPBZCINSA-N |
SMILES |
C(\C(=C\C=C\(CN1CCOCC1)CO)CO)N1CCOCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950487 |