| SpectraBase Compound ID | LEjV0hk3Gur |
|---|---|
| InChI | InChI=1S/C24H3F15/c25-10-7(11(26)17(32)22(37)16(10)31)4-1-5(8-12(27)18(33)23(38)19(34)13(8)28)3-6(2-4)9-14(29)20(35)24(39)21(36)15(9)30/h1-3H |
| InChIKey | AYTUNVSZGIICMX-UHFFFAOYSA-N |
| Mol Weight | 576.26 g/mol |
| Molecular Formula | C24H3F15 |
| Exact Mass | 575.999523 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ATwpHtMKTD2 |
|---|---|
| Name | 1,1':3',1''-Terphenyl, 2,2'',3,3'',4,4'',5,5'',6,6''-decafluoro-5'-(pentafluorophenyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 575.999522542 u |
| Formula | C24H3F15 |
| InChI | InChI=1S/C24H3F15/c25-10-7(11(26)17(32)22(37)16(10)31)4-1-5(8-12(27)18(33)23(38)19(34)13(8)28)3-6(2-4)9-14(29)20(35)24(39)21(36)15(9)30/h1-3H |
| InChIKey | AYTUNVSZGIICMX-UHFFFAOYSA-N |
| Molecular Weight | 576.264 g/mol |
| SMILES | C1=C(C=C(C=C1C1=C(C(=C(C(=C1F)F)F)F)F)C1=C(C(=C(C(=C1F)F)F)F)F)C1=C(C(=C(C(=C1F)F)F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.887396 |