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1-(1,3-benzodioxol-5-yl)-5-(methylsulfonyl)-1H-tetraazole

View entire compound with spectra: 1 NMR

1-(1,3-benzodioxol-5-yl)-5-(methylsulfonyl)-1H-tetraazole
SpectraBase Compound ID yu0yoHTvbF
InChI InChI=1S/C9H8N4O4S/c1-18(14,15)9-10-11-12-13(9)6-2-3-7-8(4-6)17-5-16-7/h2-4H,5H2,1H3
InChIKey BPZJPNNURHGQEA-UHFFFAOYSA-N
Mol Weight 268.25 g/mol
Molecular Formula C9H8N4O4S
Exact Mass 268.026626 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5JkXweU7kch
Name 1-(1,3-benzodioxol-5-yl)-5-(methylsulfonyl)-1H-tetraazole
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.026625924 u
Formula C9H8N4O4S
InChI InChI=1S/C9H8N4O4S/c1-18(14,15)9-10-11-12-13(9)6-2-3-7-8(4-6)17-5-16-7/h2-4H,5H2,1H3
InChIKey BPZJPNNURHGQEA-UHFFFAOYSA-N
Molecular Weight 268.247 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8772
Solvent DMSO-d6
Source Vendor ID: NMR/13228051