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acetic acid, [[2,4-dinitro-6-[(phenylmethyl)thio]benzoyl]amino]-,methyl ester
SpectraBase Compound ID GyYBPtKYYZS
InChI InChI=1S/C17H15N3O7S/c1-27-15(21)9-18-17(22)16-13(20(25)26)7-12(19(23)24)8-14(16)28-10-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,18,22)
InChIKey MOGDMFFFHPGUKE-UHFFFAOYSA-N
Mol Weight 405.38 g/mol
Molecular Formula C17H15N3O7S
Exact Mass 405.063071 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FtcDTdKPHSk
Name acetic acid, [[2,4-dinitro-6-[(phenylmethyl)thio]benzoyl]amino]-,methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.063071002 u
Formula C17H15N3O7S
InChI InChI=1S/C17H15N3O7S/c1-27-15(21)9-18-17(22)16-13(20(25)26)7-12(19(23)24)8-14(16)28-10-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,18,22)
InChIKey MOGDMFFFHPGUKE-UHFFFAOYSA-N
Molecular Weight 405.381 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10146
Solvent DMSO-d6
Source Vendor ID: NMR/10240121; Lab Info: L-12; Lab Number: Serebryakov,L-12