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1H-tetrazol-5-amine, N-[[3-ethoxy-4-(2-thienylmethoxy)phenyl]methyl]-1-methyl-
SpectraBase Compound ID 1MbryiLFut5
InChI InChI=1S/C16H19N5O2S/c1-3-22-15-9-12(10-17-16-18-19-20-21(16)2)6-7-14(15)23-11-13-5-4-8-24-13/h4-9H,3,10-11H2,1-2H3,(H,17,18,20)
InChIKey NUSCXANTLRFWBW-UHFFFAOYSA-N
Mol Weight 345.42 g/mol
Molecular Formula C16H19N5O2S
Exact Mass 345.125946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FdkK9vKUNxE
Name 1H-Tetrazol-5-amine, N-[[3-ethoxy-4-(2-thienylmethoxy)phenyl]methyl]-1-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.125946044 u
Formula C16H19N5O2S
InChI InChI=1S/C16H19N5O2S/c1-3-22-15-9-12(10-17-16-18-19-20-21(16)2)6-7-14(15)23-11-13-5-4-8-24-13/h4-9H,3,10-11H2,1-2H3,(H,17,18,20)
InChIKey NUSCXANTLRFWBW-UHFFFAOYSA-N
Molecular Weight 345.421 g/mol
SMILES C=1(N(N=NN1)C)NCC=1C=C(OCC)C(=CC1)OCC=1SC=CC1