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1-(2-THENOYL)-2-{[5-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-2H-TETRAZOL-2-YL]ACETYL}HYDRAZINE

View entire compound with spectra: 3 NMR, and 1 FTIR

1-(2-THENOYL)-2-{[5-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-2H-TETRAZOL-2-YL]ACETYL}HYDRAZINE
SpectraBase Compound ID Cy3gts3Rpll
InChI InChI=1S/C15H11F3N6O2S/c16-15(17,18)10-4-1-3-9(7-10)13-20-23-24(22-13)8-12(25)19-21-14(26)11-5-2-6-27-11/h1-7H,8H2,(H,19,25)(H,21,26)
InChIKey NTEGWUUGIBZMKG-UHFFFAOYSA-N
Mol Weight 396.35 g/mol
Molecular Formula C15H11F3N6O2S
Exact Mass 396.061629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FH1fXJhwxtV
Name 1-(2-Thenoyl)-2-[[5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2H-tetrazol-2-yl]acetyl}hydrazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.061629279 u
Formula C15H11F3N6O2S
InChI InChI=1S/C15H11F3N6O2S/c16-15(17,18)10-4-1-3-9(7-10)13-20-23-24(22-13)8-12(25)19-21-14(26)11-5-2-6-27-11/h1-7H,8H2,(H,19,25)(H,21,26)
InChIKey NTEGWUUGIBZMKG-UHFFFAOYSA-N
Molecular Weight 396.348 g/mol
SMILES N(C(CN1N=C(C2=CC=CC(=C2)C(F)(F)F)N=N1)=O)NC(=O)C=1SC=CC1