SpectraBase Spectrum ID |
K698JB1hZRs |
Name |
Hydrogen-oligo[tri(oxyethylene)oxyadipoyl] hydroxide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
320.219888744 u |
Formula |
C16H32O6 |
InChI |
InChI=1S/C8H18O4.C8H14O2/c1-9-3-5-11-7-8-12-6-4-10-2;1-7(9)5-3-4-6-8(2)10/h3-8H2,1-2H3;3-6H2,1-2H3 |
InChIKey |
QJQSIGWFLZUZSH-UHFFFAOYSA-N |
Molecular Weight |
320.426 g/mol |
Nominal Mass |
320 u |
SMILES |
C(OC)COCCOCCOC.C(CCCC(=O)C)C(C)=O |
Spectrum/Structure Validation Score (Raman) |
0.907197 |