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1-methyl-4-phenyl-3-(trifluoromethyl)-1-azaspiro[4.5]deca-3,6,9-triene-2,8-diol
SpectraBase Compound ID IXy2b6IePUa
InChI InChI=1S/C17H16F3NO2/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/h2-10,12,15,22-23H,1H3/i22+2,23+2
InChIKey WWXGQPJPUMBCJY-YHOVWZCOSA-N
Mol Weight 327.32 g/mol
Molecular Formula C17H16F3N18O2
Exact Mass 327.121803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XcnEmpfMW
Name 1-methyl-4-phenyl-3-(trifluoromethyl)-1-azaspiro[4.5]deca-3,6,9-triene-2,8-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.121803234 u
Formula C17H16F3N[18O]2
InChI InChI=1S/C17H16F3NO2/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/h2-10,12,15,22-23H,1H3/i22+2,23+2
InChIKey WWXGQPJPUMBCJY-YHOVWZCOSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405672
Molecular Weight 327.316 g/mol
Quality 921
SMILES [18OH]C1C(=C(C2(C=CC(C=C2)[18OH])N1C)C1=CC=CC=C1)C(F)(F)F
SPLASH splash10-01b9-6954000000-79a1eb0c71b6d82c3c0a
Source of Spectrum QE-21-SM7-7-1 (DOI: 10.1002/chem.201405672)
Wiley ID 1909280