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1-methyl-4-phenyl-3-(trifluoromethyl)-1-azaspiro[4.5]deca-3,6,9-triene-2,8-dione
SpectraBase Compound ID yYonfRh2kv
InChI InChI=1S/C17H12F3NO2/c1-21-15(23)14(17(18,19)20)13(11-5-3-2-4-6-11)16(21)9-7-12(22)8-10-16/h2-10H,1H3/i22+2,23+2
InChIKey APBQDKXZXWTUDX-YHOVWZCOSA-N
Mol Weight 323.28 g/mol
Molecular Formula C17H12F3N18O2
Exact Mass 323.090503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAXuZmW5jjY
Name 1-methyl-4-phenyl-3-(trifluoromethyl)-1-azaspiro[4.5]deca-3,6,9-triene-2,8-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 323.090503105 u
Formula C17H12F3N[18O]2
InChI InChI=1S/C17H12F3NO2/c1-21-15(23)14(17(18,19)20)13(11-5-3-2-4-6-11)16(21)9-7-12(22)8-10-16/h2-10H,1H3/i22+2,23+2
InChIKey APBQDKXZXWTUDX-YHOVWZCOSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405672
Molecular Weight 323.284 g/mol
Quality 914
SMILES C=1C(C=CC2(C1)C(=C(C(N2C)=[18O])C(F)(F)F)C1=CC=CC=C1)=[18O]
SPLASH splash10-01bc-5955000000-4a564a02d7381b59082e
Source of Spectrum QE-21-SM6-6-1 (DOI: 10.1002/chem.201405672)
Wiley ID 1909279