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1H-indazole, 4-[(2-methylpropyl)thio]-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-
SpectraBase Compound ID 79szuK4J7zA
InChI InChI=1S/C20H21N3O3S2/c1-13(2)12-28-17-11-15(23(24)25)10-16-18(17)19(20-26-8-9-27-20)21-22(16)14-6-4-3-5-7-14/h3-7,10-11,13,20H,8-9,12H2,1-2H3
InChIKey XZLUTCOCFALZAS-UHFFFAOYSA-N
Mol Weight 415.53 g/mol
Molecular Formula C20H21N3O3S2
Exact Mass 415.102434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 59Y9EPYWQHl
Name 1H-indazole, 4-[(2-methylpropyl)thio]-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.102433893 u
Formula C20H21N3O3S2
InChI InChI=1S/C20H21N3O3S2/c1-13(2)12-28-17-11-15(23(24)25)10-16-18(17)19(20-26-8-9-27-20)21-22(16)14-6-4-3-5-7-14/h3-7,10-11,13,20H,8-9,12H2,1-2H3
InChIKey XZLUTCOCFALZAS-UHFFFAOYSA-N
Molecular Weight 415.526 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16700
Solvent DMSO-d6
Source Vendor ID: NMR/11230129; Lab Info: DAL; Lab Number: Vin-0040