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thieno[2,3-b]pyridine-2-carboxylic acid, 3,6-diamino-5-cyano-4-(4-ethoxyphenyl)-, methyl ester
SpectraBase Compound ID IPYOU2Jt3pr
InChI InChI=1S/C18H16N4O3S/c1-3-25-10-6-4-9(5-7-10)12-11(8-19)16(21)22-17-13(12)14(20)15(26-17)18(23)24-2/h4-7H,3,20H2,1-2H3,(H2,21,22)
InChIKey QPOFBONQGFKGSR-UHFFFAOYSA-N
Mol Weight 368.41 g/mol
Molecular Formula C18H16N4O3S
Exact Mass 368.094312 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JqMOoHNsAlU
Name thieno[2,3-b]pyridine-2-carboxylic acid, 3,6-diamino-5-cyano-4-(4-ethoxyphenyl)-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.094311562 u
Formula C18H16N4O3S
InChI InChI=1S/C18H16N4O3S/c1-3-25-10-6-4-9(5-7-10)12-11(8-19)16(21)22-17-13(12)14(20)15(26-17)18(23)24-2/h4-7H,3,20H2,1-2H3,(H2,21,22)
InChIKey QPOFBONQGFKGSR-UHFFFAOYSA-N
Molecular Weight 368.411 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1605
Solvent DMSO-d6
Source Vendor ID: ZI/8158573; Lab Info: KR; Lab Number: KR-ug00111
Temperature 29.85 °C