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acetamide, N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-
SpectraBase Compound ID EhS7hnePTW4
InChI InChI=1S/C17H12F6N2O4S/c1-29-13-4-2-9(16(18,19)20)6-11(13)24-15(26)8-30-14-5-3-10(17(21,22)23)7-12(14)25(27)28/h2-7H,8H2,1H3,(H,24,26)
InChIKey OMJGNHAOUQWRSM-UHFFFAOYSA-N
Mol Weight 454.34 g/mol
Molecular Formula C17H12F6N2O4S
Exact Mass 454.042197 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GBl4FhYdOnj
Name acetamide, N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 454.042197022 u
Formula C17H12F6N2O4S
InChI InChI=1S/C17H12F6N2O4S/c1-29-13-4-2-9(16(18,19)20)6-11(13)24-15(26)8-30-14-5-3-10(17(21,22)23)7-12(14)25(27)28/h2-7H,8H2,1H3,(H,24,26)
InChIKey OMJGNHAOUQWRSM-UHFFFAOYSA-N
Molecular Weight 454.343 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4100
Solvent DMSO-d6
Source Vendor ID: NMR/9245531; Lab Info: LP; Lab Number: LP-1401589
Temperature 29.85 °C