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acetamide, N-(5-methyl-3-isoxazolyl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-
SpectraBase Compound ID A3DOHIgto2Y
InChI InChI=1S/C18H18N6O2S/c1-3-8-24-13-7-5-4-6-12(13)16-17(24)20-18(22-21-16)27-10-15(25)19-14-9-11(2)26-23-14/h4-7,9H,3,8,10H2,1-2H3,(H,19,23,25)
InChIKey XOXBOQPXJXIEIL-UHFFFAOYSA-N
Mol Weight 382.44 g/mol
Molecular Formula C18H18N6O2S
Exact Mass 382.121195 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hr19HqCiEAM
Name acetamide, N-(5-methyl-3-isoxazolyl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.121195016 u
Formula C18H18N6O2S
InChI InChI=1S/C18H18N6O2S/c1-3-8-24-13-7-5-4-6-12(13)16-17(24)20-18(22-21-16)27-10-15(25)19-14-9-11(2)26-23-14/h4-7,9H,3,8,10H2,1-2H3,(H,19,23,25)
InChIKey XOXBOQPXJXIEIL-UHFFFAOYSA-N
Molecular Weight 382.442 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1858
Solvent DMSO-d6
Source Vendor ID: ZI/8059447; Lab Info: L-23,Ezhova; Lab Number: L-23/0005687