Debug Info

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_id
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63CA1jZXVRk
spectrumID
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63CA1jZXVRk
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analyticalTechnique
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1H NMR
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1H Nuclear Magnetic Resonance (NMR) Spectrum
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1H-1,2,4-triazole, 1-(ethylsulfonyl)-3-phenyl-5-[(phenylmethyl)thio]-
SpectraBase Compound ID G2Gs0i0mVSw
InChI InChI=1S/C17H17N3O2S2/c1-2-24(21,22)20-17(23-13-14-9-5-3-6-10-14)18-16(19-20)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
InChIKey HWWQAJRAQKTWEP-UHFFFAOYSA-N
Mol Weight 359.46 g/mol
Molecular Formula C17H17N3O2S2
Exact Mass 359.076219 g/mol
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1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 63CA1jZXVRk
Name 1H-1,2,4-triazole, 1-(ethylsulfonyl)-3-phenyl-5-[(phenylmethyl)thio]-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.076219145 u
Formula C17H17N3O2S2
InChI InChI=1S/C17H17N3O2S2/c1-2-24(21,22)20-17(23-13-14-9-5-3-6-10-14)18-16(19-20)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
InChIKey HWWQAJRAQKTWEP-UHFFFAOYSA-N
Molecular Weight 359.462 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7746
Solvent DMSO-d6
Source Vendor ID: NMR/13308582
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