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benzeneacetamide, 4-[(3a,4,6,6a-tetrahydro-5,5-dioxidothieno[3,4-d]thiazol-2-yl)amino]-N-(1,3-benzodioxol-5-ylmethyl)-
SpectraBase Compound ID F0rvobHXZRr
InChI InChI=1S/C21H21N3O5S2/c25-20(22-9-14-3-6-17-18(7-14)29-12-28-17)8-13-1-4-15(5-2-13)23-21-24-16-10-31(26,27)11-19(16)30-21/h1-7,16,19H,8-12H2,(H,22,25)(H,23,24)
InChIKey ODIPNXKARGEULB-UHFFFAOYSA-N
Mol Weight 459.54 g/mol
Molecular Formula C21H21N3O5S2
Exact Mass 459.092263 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IkyfLKsfOBF
Name benzeneacetamide, 4-[(3a,4,6,6a-tetrahydro-5,5-dioxidothieno[3,4-d]thiazol-2-yl)amino]-N-(1,3-benzodioxol-5-ylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 459.092263131 u
Formula C21H21N3O5S2
InChI InChI=1S/C21H21N3O5S2/c25-20(22-9-14-3-6-17-18(7-14)29-12-28-17)8-13-1-4-15(5-2-13)23-21-24-16-10-31(26,27)11-19(16)30-21/h1-7,16,19H,8-12H2,(H,22,25)(H,23,24)
InChIKey ODIPNXKARGEULB-UHFFFAOYSA-N
Molecular Weight 459.535 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4619
Solvent DMSO-d6
Source Vendor ID: NMR/13288259