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3-(Morpholine-4-carbonyl)phenyl trifluoromethanesulfonate
SpectraBase Compound ID 3YwWJJrNZth
InChI InChI=1S/C12H12F3NO5S/c13-12(14,15)22(18,19)21-10-3-1-2-9(8-10)11(17)16-4-6-20-7-5-16/h1-3,8H,4-7H2
InChIKey HXAJOOSTZLXSRM-UHFFFAOYSA-N
Mol Weight 339.29 g/mol
Molecular Formula C12H12F3NO5S
Exact Mass 339.038828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NeKX4oMbZI
Name 3-(Morpholine-4-carbonyl)phenyl trifluoromethanesulfonate
Appearance Viscous oil
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Exact Mass 339.038828148 u
Formula C12H12F3NO5S
InChI InChI=1S/C12H12F3NO5S/c13-12(14,15)22(18,19)21-10-3-1-2-9(8-10)11(17)16-4-6-20-7-5-16/h1-3,8H,4-7H2
InChIKey HXAJOOSTZLXSRM-UHFFFAOYSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/chem.201702015
Molecular Weight 339.285 g/mol
Quality 358
Reported Formula C12H12O5NF3S
SMILES C1OCCN(C1)C(=O)C=1C=C(C=CC1)OS(C(F)(F)F)(=O)=O
SPLASH splash10-0n29-9220000000-da369417db4c757ef9f4
Source of Spectrum QE-23-13376-3b (DOI: 10.1002/chem.201702015)
Wiley ID 1905846