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7-Ethyl 3-methyl 8-methyl-1,9-diphenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
SpectraBase Compound ID 4g129ce7Zvg
InChI InChI=1S/C22H21N3O4S2/c1-4-29-20(26)18-15(2)24(16-11-7-5-8-12-16)22(30-18)25(17-13-9-6-10-14-17)23-19(31-22)21(27)28-3/h5-14H,4H2,1-3H3
InChIKey BEINOCSYNIDIRQ-UHFFFAOYSA-N
Mol Weight 455.55 g/mol
Molecular Formula C22H21N3O4S2
Exact Mass 455.097349 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Madu7BueCS
Name 4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylic acid,8-methyl-1,9-diphenyl-, 7-ethyl 3-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 455.097348512 u
Formula C22H21N3O4S2
InChI InChI=1S/C22H21N3O4S2/c1-4-29-20(26)18-15(2)24(16-11-7-5-8-12-16)22(30-18)25(17-13-9-6-10-14-17)23-19(31-22)21(27)28-3/h5-14H,4H2,1-3H3
InChIKey BEINOCSYNIDIRQ-UHFFFAOYSA-N
Molecular Weight 455.547 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17472
Solvent DMSO-d6
Source Vendor ID: NMR/11211485; Lab Info: LP; Lab Number: LP-0302461