| SpectraBase Spectrum ID |
Bu2sy5bcswa |
| Name |
3,4-Furandicarboxylic acid, tetrahydro-2,5-diphenyl-, (2.alpha.,3.beta.,4.beta.,5.alpha.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
312.099773610 u |
| Formula |
C18H16O5 |
| InChI |
InChI=1S/C18H16O5/c19-17(20)13-14(18(21)22)16(12-9-5-2-6-10-12)23-15(13)11-7-3-1-4-8-11/h1-10,13-16H,(H,19,20)(H,21,22)/t13-,14+,15+,16- |
| InChIKey |
NQUGBODTSLRVGH-SYMSYNOKSA-N |
| SMILES |
[C@]1([C@]([C@](C2=CC=CC=C2)(O[C@@]1(C=1C=CC=CC1)[H])[H])(C(=O)O)[H])(C(=O)O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.980561 |
