| SpectraBase Spectrum ID |
IJJXYBh7tIu |
| Name |
D-Arabino-hex-1-enitol, 1,2-dideoxy-3,4,5-tris-o-(phenylmethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.214409442 u |
| Formula |
C27H30O4 |
| InChI |
InChI=1S/C27H30O4/c1-2-25(29-19-22-12-6-3-7-13-22)27(31-21-24-16-10-5-11-17-24)26(18-28)30-20-23-14-8-4-9-15-23/h2-17,25-28H,1,18-21H2 |
| InChIKey |
NTOSGFLXZNOARL-UHFFFAOYSA-N |
| Molecular Weight |
418.533 g/mol |
| SMILES |
C(OCC=1C=CC=CC1)(C(OCC=1C=CC=CC1)CO)C(OCC1=CC=CC=C1)C=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878689 |
