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2-[(cyanomethyl)sulfanyl]-6-methyl-4-(trifluoromethyl)nicotinonitrile
SpectraBase Compound ID 38qygZh19EL
InChI InChI=1S/C10H6F3N3S/c1-6-4-8(10(11,12)13)7(5-15)9(16-6)17-3-2-14/h4H,3H2,1H3
InChIKey PHXRKQRYSMIEAY-UHFFFAOYSA-N
Mol Weight 257.23 g/mol
Molecular Formula C10H6F3N3S
Exact Mass 257.023453 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KI3X4ccOIXh
Name 2-[(cyanomethyl)sulfanyl]-6-methyl-4-(trifluoromethyl)nicotinonitrile
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/C10H6F3N3S/c1-6-4-8(10(11,12)13)7(5-15)9(16-6)17-3-2-14/h4H,3H2,1H3
InChIKey PHXRKQRYSMIEAY-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2282
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/8049555; UBI_ID: UBI-002283
Temperature 308 °C