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1-[3-(Trifluoromethyl)phenyl]-1,2-dihydro-3,6-pyridazinedione
SpectraBase Compound ID JdG31AiKSyC
InChI InChI=1S/C11H7F3N2O2/c12-11(13,14)7-2-1-3-8(6-7)16-10(18)5-4-9(17)15-16/h1-6H,(H,15,17)
InChIKey DBAHMNGRXMJPSK-UHFFFAOYSA-N
Mol Weight 256.18 g/mol
Molecular Formula C11H7F3N2O2
Exact Mass 256.045962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jSWcYQo9VS
Name 1-[3-(Trifluoromethyl)phenyl]-1,2-dihydro-3,6-pyridazinedione
Alternate Name(s) 2-[3-(trifluoromethyl)phenyl]-1H-pyridazine-3,6-dione 2-[3-(trifluoromethyl)phenyl]-1H-pyridazine-3,6-quinone Pyridazine-3,6(1H,2H)-dione, 1-(3-trifluoromethylphenyl)-
CAS Registry Number 50500-96-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7F3N2O2
InChI InChI=1S/C11H7F3N2O2/c12-11(13,14)7-2-1-3-8(6-7)16-10(18)5-4-9(17)15-16/h1-6H,(H,15,17)
InChIKey DBAHMNGRXMJPSK-UHFFFAOYSA-N
Molecular Weight 256.184 g/mol
SMILES N1C(C=CC(N1c1cc(C(F)(F)F)ccc1)=O)=O
SPLASH splash10-0a4i-9440000000-7c4b2b9cafbcc92b3a8d
Source of Spectrum AD-0-2532-0
Wiley ID 1433788