| SpectraBase Spectrum ID |
HuItFeDAABT |
| Name |
[5,16-Dihydroxy[2.2]paracyclophane-4,13-diyl]-BIS9PHENYLMETHANONE) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.167459249 u |
| Formula |
C30H24O4 |
| InChI |
InChI=1S/C30H24O4/c31-26-18-23-15-12-19-11-13-22(30(34)27(19)29(33)21-9-5-2-6-10-21)14-16-24(26)17-25(23)28(32)20-7-3-1-4-8-20/h1-11,13,17-18,31,34H,12,14-16H2 |
| InChIKey |
CRXSFDMBIFFZBD-UHFFFAOYSA-N |
| Molecular Weight |
448.518 g/mol |
| SMILES |
C=1(C(=O)C2=CC=CC=C2)C(=C2CCC3=CC(=C(CCC1C=C2)C=C3O)C(=O)C=1C=CC=CC1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951207 |
![[5,16-Dihydroxy[2.2]paracyclophane-4,13-diyl]-bis9phenylmethanone)](/api/spectrum/HuItFeDAABT/structure.png?h=300&w=458 "[5,16-Dihydroxy[2.2]paracyclophane-4,13-diyl]-bis9phenylmethanone)")
