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3-phenylpropyl 1H-1,2,4-triazol-3-yl sulfone
SpectraBase Compound ID Fsmy9SVcY8E
InChI InChI=1S/C11H13N3O2S/c15-17(16,11-12-9-13-14-11)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2,(H,12,13,14)
InChIKey BNAGZZVWNFFXPS-UHFFFAOYSA-N
Mol Weight 251.3 g/mol
Molecular Formula C11H13N3O2S
Exact Mass 251.072848 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EXqV3skh93J
Name 3-phenylpropyl 1H-1,2,4-triazol-3-yl sulfone
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C11H13N3O2S/c15-17(16,11-12-9-13-14-11)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2,(H,12,13,14)
InChIKey BNAGZZVWNFFXPS-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26626
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D63683; Labnumber: TOLST-1226; SBI_ID: SBI-026630
Synonyms 3-[(3-phenylpropyl)sulfonyl]-1H-1,2,4-triazole
Temperature 315 °C