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(1S,2S,5R)-2-(3-((1R,2R,5S)-4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-2-thioxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one

View entire compound with spectra: 1 NMR

(1S,2S,5R)-2-(3-((1R,2R,5S)-4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-2-thioxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
SpectraBase Compound ID GzgzrAJ3DYz
InChI InChI=1S/C19H18N2O6S/c22-13-5-11(15-7-24-17(13)26-15)20-9-3-1-2-4-10(9)21(19(20)28)12-6-14(23)18-25-8-16(12)27-18/h1-4,11-12,15-18H,5-8H2/t11-,12+,15+,16-,17+,18-
InChIKey RQGIDQQMSDJKIJ-PUQNQXMMSA-N
Mol Weight 402.42 g/mol
Molecular Formula C19H18N2O6S
Exact Mass 402.088557 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3RRo5LONxMq
Name (1S,2S,5R)-2-(3-((1R,2R,5S)-4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-2-thioxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.088557476 u
Formula C19H18N2O6S
InChI InChI=1S/C19H18N2O6S/c22-13-5-11(15-7-24-17(13)26-15)20-9-3-1-2-4-10(9)21(19(20)28)12-6-14(23)18-25-8-16(12)27-18/h1-4,11-12,15-18H,5-8H2/t11-,12+,15+,16-,17+,18-
InChIKey RQGIDQQMSDJKIJ-PUQNQXMMSA-N
Molecular Weight 402.421 g/mol
NMR Offset 17.9896
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2085
Solvent CDCl3
Source Vendor ID: NMR/13216955; Lab Info: SF; Lab Number: SF-AK00129