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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[(2-fluorophenyl)methoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-,
SpectraBase Compound ID EAjYyIECilQ
InChI InChI=1S/C22H19FN4O2S/c1-13(2)21-26-27-19(24)17(20(28)25-22(27)30-21)11-14-7-9-16(10-8-14)29-12-15-5-3-4-6-18(15)23/h3-11,13,24H,12H2,1-2H3/b17-11-,24-19?
InChIKey UXOWNSUVRFVNHF-GLGSTRKCSA-N
Mol Weight 422.48 g/mol
Molecular Formula C22H19FN4O2S
Exact Mass 422.121275 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LWIxxi92uCS
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[(2-fluorophenyl)methoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-,
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.121275203 u
Formula C22H19FN4O2S
InChI InChI=1S/C22H19FN4O2S/c1-13(2)21-26-27-19(24)17(20(28)25-22(27)30-21)11-14-7-9-16(10-8-14)29-12-15-5-3-4-6-18(15)23/h3-11,13,24H,12H2,1-2H3/b17-11-,24-19?
InChIKey UXOWNSUVRFVNHF-GLGSTRKCSA-N
Molecular Weight 422.478 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15618
Solvent DMSO-d6
Source Vendor ID: ZI/10033526; Lab Info: CEP; Lab Number: CEP-6700165