SpectraBase Compound ID | LO9eR6U2T6u |
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InChI | InChI=1S/C18H19BrN2O4S2/c1-12(22)13-4-2-6-15(10-13)20-18(23)14-5-3-9-21(11-14)27(24,25)17-8-7-16(19)26-17/h2,4,6-8,10,14H,3,5,9,11H2,1H3,(H,20,23) |
InChIKey | PCMVMIXBPKAQPN-UHFFFAOYSA-N |
Mol Weight | 471.38 g/mol |
Molecular Formula | C18H19BrN2O4S2 |
Exact Mass | 469.996962 g/mol |
SpectraBase Spectrum ID | FEzx5vDPMpU |
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Name | N-(3-acetylphenyl)-1-[(5-bromo-2-thienyl)sulfonyl]-3-piperidinecarboxamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 469.996962444 u |
Formula | C18H19BrN2O4S2 |
InChI | InChI=1S/C18H19BrN2O4S2/c1-12(22)13-4-2-6-15(10-13)20-18(23)14-5-3-9-21(11-14)27(24,25)17-8-7-16(19)26-17/h2,4,6-8,10,14H,3,5,9,11H2,1H3,(H,20,23) |
InChIKey | PCMVMIXBPKAQPN-UHFFFAOYSA-N |
Molecular Weight | 471.384 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_3045 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12288330 |