SpectraBase Compound ID | 1zMeZf2dTw |
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InChI | InChI=1S/C12H2F8O2.O/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16;/h21-22H; |
InChIKey | ODUJGOFJYCTVSO-UHFFFAOYSA-N |
Mol Weight | 346.132 g/mol |
Molecular Formula | C12H2F8O3 |
Exact Mass | 345.987619 g/mol |
SpectraBase Spectrum ID | JUrzbpd5Mir |
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Name | 2,2',3,3',5,5',6,6'-Octafluoro-4,4'-biphenol hydrate |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 378763 |
CAS Registry Number | 207596-28-9 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H2F8O3 |
InChI | InChI=1S/C12H2F8O2.O/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16;/h21-22H; |
InChIKey | ODUJGOFJYCTVSO-UHFFFAOYSA-N |
Observed nucleus | 13C |
Purity | 99% |
Solvent | DMSO-d6 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_008218 |