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N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
SpectraBase Compound ID 6Y0Hn1vD41z
InChI InChI=1S/C16H17N5O3S/c1-9-3-4-11-12(7-17)16(25-13(11)5-9)18-15(22)8-20-10(2)6-14(19-20)21(23)24/h6,9H,3-5,8H2,1-2H3,(H,18,22)
InChIKey SJRFQQUPAQTQFN-UHFFFAOYSA-N
Mol Weight 359.4 g/mol
Molecular Formula C16H17N5O3S
Exact Mass 359.105211 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LL1nXQU6cOw
Name N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
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/C16H17N5O3S/c1-9-3-4-11-12(7-17)16(25-13(11)5-9)18-15(22)8-20-10(2)6-14(19-20)21(23)24/h6,9H,3-5,8H2,1-2H3,(H,18,22)
InChIKey SJRFQQUPAQTQFN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15688
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/8020634; UBI_ID: UBI-015691
Temperature 308 °C