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4-((Phenylamino)methyl)phenyl trifluoromethanesulfonate
SpectraBase Compound ID 10WoeT1IocK
InChI InChI=1S/C14H12F3NO3S/c15-14(16,17)22(19,20)21-13-8-6-11(7-9-13)10-18-12-4-2-1-3-5-12/h1-9,18H,10H2
InChIKey LPCGBDFZRIWMGN-UHFFFAOYSA-N
Mol Weight 331.31 g/mol
Molecular Formula C14H12F3NO3S
Exact Mass 331.048999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4diGTgF3QW
Name 4-((Phenylamino)methyl)phenyl trifluoromethanesulfonate
Appearance Yellow oil
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Exact Mass 331.048998910 u
Formula C14H12F3NO3S
InChI InChI=1S/C14H12F3NO3S/c15-14(16,17)22(19,20)21-13-8-6-11(7-9-13)10-18-12-4-2-1-3-5-12/h1-9,18H,10H2
InChIKey LPCGBDFZRIWMGN-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201604452
Molecular Weight 331.309 g/mol
Quality 64
SMILES N(C1=CC=CC=C1)CC1=CC=C(C=C1)OS(C(F)(F)F)(=O)=O
SPLASH splash10-016u-9744000000-9c1e5f17a42059839775
Source of Spectrum QE-22-SM12-8 (DOI: 10.1002/chem.201604452)
Wiley ID 1905296