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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-

View entire compound with spectra: 1 NMR

7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-
SpectraBase Compound ID J5mdhaClhm7
InChI InChI=1S/C28H32N4O5S/c1-17(2)27-31-32-25(29)22(26(33)30-28(32)38-27)15-20-7-9-23(24(16-20)34-5)37-13-11-35-10-12-36-21-8-6-18(3)19(4)14-21/h6-9,14-17,29H,10-13H2,1-5H3/b22-15-,29-25?
InChIKey JWVVSIPSBFUVRZ-ZFLZBDSRSA-N
Mol Weight 536.6 g/mol
Molecular Formula C28H32N4O5S
Exact Mass 536.209341 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9Exml94UaPC
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 536.209341315 u
Formula C28H32N4O5S
InChI InChI=1S/C28H32N4O5S/c1-17(2)27-31-32-25(29)22(26(33)30-28(32)38-27)15-20-7-9-23(24(16-20)34-5)37-13-11-35-10-12-36-21-8-6-18(3)19(4)14-21/h6-9,14-17,29H,10-13H2,1-5H3/b22-15-,29-25?
InChIKey JWVVSIPSBFUVRZ-ZFLZBDSRSA-N
Molecular Weight 536.647 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15606
Solvent DMSO-d6
Source Vendor ID: ZI/10030729; Lab Info: CEP; Lab Number: CEP-6700834