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4-cyano-5-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)-N,N,3-trimethyl-2-thiophenecarboxamide
SpectraBase Compound ID A94eu3xK9vK
InChI InChI=1S/C17H17N3O4S/c1-7-8(6-18)17(25-13(7)16(23)19(2)3)20-14(21)11-9-4-5-10(24-9)12(11)15(20)22/h9-12H,4-5H2,1-3H3/t9-,10+,11-,12-/m0/s1
InChIKey XURGRKISLZPMCC-USZNOCQGSA-N
Mol Weight 359.4 g/mol
Molecular Formula C17H17N3O4S
Exact Mass 359.093977 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GTR893aOccS
Name 4-cyano-5-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)-N,N,3-trimethyl-2-thiophenecarboxamide
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/C17H17N3O4S/c1-7-8(6-18)17(25-13(7)16(23)19(2)3)20-14(21)11-9-4-5-10(24-9)12(11)15(20)22/h9-12H,4-5H2,1-3H3/t9-,10+,11-,12-/m0/s1
InChIKey XURGRKISLZPMCC-USZNOCQGSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15547
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/9686274; Labnumber: NSB-0098975; UZI_ID: UZI-015551
Temperature 308 °C