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N-(3-butyl-7-methyl-2,4-dioxo-1,2,3,4-tetrahydrobenzo[g]pteridin-8-yl)-2,2,2-trifluoroacetamide
SpectraBase Compound ID 5p3XJbuuKgh
InChI InChI=1S/C17H16F3N5O3/c1-3-4-5-25-14(26)12-13(24-16(25)28)22-11-7-9(8(2)6-10(11)21-12)23-15(27)17(18,19)20/h6-7H,3-5H2,1-2H3,(H,23,27)(H,22,24,28)
InChIKey RHWCJKRFRSAVTA-UHFFFAOYSA-N
Mol Weight 395.34 g/mol
Molecular Formula C17H16F3N5O3
Exact Mass 395.120524 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IoXOcmVnTcB
Name N-(3-butyl-7-methyl-2,4-dioxo-1,2,3,4-tetrahydrobenzo[g]pteridin-8-yl)-2,2,2-trifluoroacetamide
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/C17H16F3N5O3/c1-3-4-5-25-14(26)12-13(24-16(25)28)22-11-7-9(8(2)6-10(11)21-12)23-15(27)17(18,19)20/h6-7H,3-5H2,1-2H3,(H,23,27)(H,22,24,28)
InChIKey RHWCJKRFRSAVTA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22269
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: D58442; Labnumber: KVEX-30098; SBI_ID: SBI-022273
Temperature 306 °C