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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-(1-
SpectraBase Compound ID ECPFjL72wwq
InChI InChI=1S/C23H21ClN4O3S/c1-13(2)22-27-28-20(25)16(21(29)26-23(28)32-22)10-14-8-9-18(19(11-14)30-3)31-12-15-6-4-5-7-17(15)24/h4-11,13,25H,12H2,1-3H3/b16-10-,25-20?
InChIKey NBFULSBFOJLTJD-JTPDXPAISA-N
Mol Weight 468.96 g/mol
Molecular Formula C23H21ClN4O3S
Exact Mass 468.102289 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KAZ2DiDFlPm
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-(1-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 468.102289423 u
Formula C23H21ClN4O3S
InChI InChI=1S/C23H21ClN4O3S/c1-13(2)22-27-28-20(25)16(21(29)26-23(28)32-22)10-14-8-9-18(19(11-14)30-3)31-12-15-6-4-5-7-17(15)24/h4-11,13,25H,12H2,1-3H3/b16-10-,25-20?
InChIKey NBFULSBFOJLTJD-JTPDXPAISA-N
Molecular Weight 468.959 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15624
Solvent DMSO-d6
Source Vendor ID: ZI/10033981; Lab Info: CEP; Lab Number: CEP-6700337