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4-amino-3-((3,5-bis(trifluoromethyl)phenyl)selenyl)benzenesulfonamide
SpectraBase Compound ID 9u8NXGq9rd3
InChI InChI=1S/C14H10F6N2O2SSe/c15-13(16,17)7-3-8(14(18,19)20)5-10(4-7)26-12-6-9(25(22,23)24)1-2-11(12)21/h1-6H,21H2,(H2,22,23,24)
InChIKey QLXRUEPWHMWCAH-UHFFFAOYSA-N
Mol Weight 463.27 g/mol
Molecular Formula C14H10F6N2O2SSe
Exact Mass 463.95324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjnTWPKAYpX
Name 4-amino-3-((3,5-bis(trifluoromethyl)phenyl)selenyl)benzenesulfonamide
Appearance Purple solid
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Formula C14H10F6N2O2SSe
InChI InChI=1S/C14H10F6N2O2SSe/c15-13(16,17)7-3-8(14(18,19)20)5-10(4-7)26-12-6-9(25(22,23)24)1-2-11(12)21/h1-6H,21H2,(H2,22,23,24)
InChIKey QLXRUEPWHMWCAH-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/cmdc.202100507
Molecular Weight 463.268 g/mol
Reported Formula C14H11F6N2O2SSe
SMILES Nc1ccc(S(N)(=O)=O)cc1[Se]c1cc(cc(c1)C(F)(F)F)C(F)(F)F
SPLASH splash10-01q9-6029500000-ebb838d9ac680951544b
Source of Spectrum CMC-17-8-3n
Wiley ID 1873302