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methyl 2-[(4-chloro-3-nitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID EyGaY5U5Svu
InChI InChI=1S/C16H13ClN2O5S/c1-24-16(21)13-9-3-2-4-12(9)25-15(13)18-14(20)8-5-6-10(17)11(7-8)19(22)23/h5-7H,2-4H2,1H3,(H,18,20)
InChIKey CYRGOSHIUBCKHG-UHFFFAOYSA-N
Mol Weight 380.8 g/mol
Molecular Formula C16H13ClN2O5S
Exact Mass 380.02337 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GyfanrzxvMK
Name methyl 2-[(4-chloro-3-nitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H13ClN2O5S/c1-24-16(21)13-9-3-2-4-12(9)25-15(13)18-14(20)8-5-6-10(17)11(7-8)19(22)23/h5-7H,2-4H2,1H3,(H,18,20)
InChIKey CYRGOSHIUBCKHG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10512
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9044794; Labnumber: KOL85-0307; UZI_ID: UZI-010514
Temperature 318 °C