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2-(4-Chlorophenyl)-4,4,6-tris(trifluoromethyl)-4H-1,3,5-oxadiazine
SpectraBase Compound ID 1z270SRaTh6
InChI InChI=1S/C12H4ClF9N2O/c13-6-3-1-5(2-4-6)7-23-10(11(17,18)19,12(20,21)22)24-8(25-7)9(14,15)16/h1-4H
InChIKey IQUCVDFPJNHKON-UHFFFAOYSA-N
Mol Weight 398.62 g/mol
Molecular Formula C12H4ClF9N2O
Exact Mass 397.986844 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Q0C5bxpvBa
Name 2-(4-Chlorophenyl)-4,4,6-tris(trifluoromethyl)-4H-1,3,5-oxadiazine
Alternate Name(s) 4H-1,3,5-Oxadiazine, 2-(4-chlorophenyl)-4,4,6-tris(trifluoromethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H4ClF9N2O
InChI InChI=1S/C12H4ClF9N2O/c13-6-3-1-5(2-4-6)7-23-10(11(17,18)19,12(20,21)22)24-8(25-7)9(14,15)16/h1-4H
InChIKey IQUCVDFPJNHKON-UHFFFAOYSA-N
Molecular Weight 398.616 g/mol
SMILES C1(N=C(C(F)(F)F)OC(=N1)c1ccc(cc1)Cl)(C(F)(F)F)C(F)(F)F
SPLASH splash10-014i-9632000000-bfd315b14b64f2a52185
Source of Spectrum IY-2-4875-9
Wiley ID 1656516