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isopropyl 2-[(2-phenoxybutanoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID LxV7L8bCRtC
InChI InChI=1S/C21H25NO4S/c1-4-16(26-14-9-6-5-7-10-14)19(23)22-20-18(21(24)25-13(2)3)15-11-8-12-17(15)27-20/h5-7,9-10,13,16H,4,8,11-12H2,1-3H3,(H,22,23)
InChIKey KHRDUFYTQHZUFG-UHFFFAOYSA-N
Mol Weight 387.49 g/mol
Molecular Formula C21H25NO4S
Exact Mass 387.150429 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DBSrwtDHRVa
Name isopropyl 2-[(2-phenoxybutanoyl)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/C21H25NO4S/c1-4-16(26-14-9-6-5-7-10-14)19(23)22-20-18(21(24)25-13(2)3)15-11-8-12-17(15)27-20/h5-7,9-10,13,16H,4,8,11-12H2,1-3H3,(H,22,23)
InChIKey KHRDUFYTQHZUFG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18781
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/9128798; UBI_ID: UBI-018784
Temperature 318 °C