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methyl 2-{[(4,5-dimethyl-3-isoxazolyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID BWZXOlIWZRp
InChI InChI=1S/C16H18N2O4S/c1-8-9(2)22-18-13(8)14(19)17-15-12(16(20)21-3)10-6-4-5-7-11(10)23-15/h4-7H2,1-3H3,(H,17,19)
InChIKey QQHNDOIIXZUHBO-UHFFFAOYSA-N
Mol Weight 334.39 g/mol
Molecular Formula C16H18N2O4S
Exact Mass 334.098728 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GQ5oq79LqIN
Name methyl 2-{[(4,5-dimethyl-3-isoxazolyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-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/C16H18N2O4S/c1-8-9(2)22-18-13(8)14(19)17-15-12(16(20)21-3)10-6-4-5-7-11(10)23-15/h4-7H2,1-3H3,(H,17,19)
InChIKey QQHNDOIIXZUHBO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33265
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: 1912303; SBI_ID: SBI-033269
Temperature 318 °C