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(4R,5R)-2,2-dimethyl-4,5-bis[4-(trifluoromethyl)phenyl]-1,3-dioxolane

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(4R,5R)-2,2-dimethyl-4,5-bis[4-(trifluoromethyl)phenyl]-1,3-dioxolane
SpectraBase Compound ID 8LQ4Jijgftp
InChI InChI=1S/C19H16F6O2/c1-17(2)26-15(11-3-7-13(8-4-11)18(20,21)22)16(27-17)12-5-9-14(10-6-12)19(23,24)25/h3-10,15-16H,1-2H3/t15-,16-/m1/s1
InChIKey FGUPZGYJYRUGEM-HZPDHXFCSA-N
Mol Weight 390.33 g/mol
Molecular Formula C19H16F6O2
Exact Mass 390.105449 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID G9hKoit1Bda
Name (4R,5R)-2,2-Dimethyl-4,5-bis[4-(trifluoromethyl)phenyl]-1,3-dioxolane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.105448731 u
Formula C19H16F6O2
InChI InChI=1S/C19H16F6O2/c1-17(2)26-15(11-3-7-13(8-4-11)18(20,21)22)16(27-17)12-5-9-14(10-6-12)19(23,24)25/h3-10,15-16H,1-2H3/t15-,16-/m1/s1
InChIKey FGUPZGYJYRUGEM-HZPDHXFCSA-N
Molecular Weight 390.325 g/mol
SMILES C1(O[C@@]([C@](O1)(C=1C=CC(=CC1)C(F)(F)F)[H])(C=1C=CC(=CC1)C(F)(F)F)[H])(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.923596