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3,5-DIMETHYL-4-[(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)AZO]-1-[(5-METHYL-3-PHENYL-4-ISOXAZOLYL)CARBONYL]PYRAZOLE

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3,5-DIMETHYL-4-[(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)AZO]-1-[(5-METHYL-3-PHENYL-4-ISOXAZOLYL)CARBONYL]PYRAZOLE
SpectraBase Compound ID EGF8TOS8qpd
InChI InChI=1S/C24H17F6N5O2/c1-12-20(32-31-18-10-16(23(25,26)27)9-17(11-18)24(28,29)30)13(2)35(33-12)22(36)19-14(3)37-34-21(19)15-7-5-4-6-8-15/h4-11H,1-3H3/b32-31+
InChIKey RSPOOOKZIIMJNA-QNEJGDQOSA-N
Mol Weight 521.42 g/mol
Molecular Formula C24H17F6N5O2
Exact Mass 521.128644 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IMogG1ddOK7
Name 3,5-dimethyl-4-[(a,a,a,a',a',a'-hexafluoro-3,5-xylyl)azo]-1-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]pyrazole
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H17F6N5O2
InChI InChI=1S/C24H17F6N5O2/c1-12-20(32-31-18-10-16(23(25,26)27)9-17(11-18)24(28,29)30)13(2)35(33-12)22(36)19-14(3)37-34-21(19)15-7-5-4-6-8-15/h4-11H,1-3H3/b32-31+
InChIKey RSPOOOKZIIMJNA-QNEJGDQOSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 29100M
Solvent CDCl3