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N-(4-fluorobenzyl)-2-(1H-tetraazol-1-yl)acetamide
SpectraBase Compound ID E6WV3hUEsnd
InChI InChI=1S/C10H10FN5O/c11-9-3-1-8(2-4-9)5-12-10(17)6-16-7-13-14-15-16/h1-4,7H,5-6H2,(H,12,17)
InChIKey YWWKQFBQDIOLRV-UHFFFAOYSA-N
Mol Weight 235.22 g/mol
Molecular Formula C10H10FN5O
Exact Mass 235.086938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JWYv0C6x3Uk
Name N-(4-Fluorobenzyl)-2-(1H-tetraazol-1-yl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.086938124 u
Formula C10H10FN5O
InChI InChI=1S/C10H10FN5O/c11-9-3-1-8(2-4-9)5-12-10(17)6-16-7-13-14-15-16/h1-4,7H,5-6H2,(H,12,17)
InChIKey YWWKQFBQDIOLRV-UHFFFAOYSA-N
Molecular Weight 235.222 g/mol
SMILES N(C(CN1N=NN=C1)=O)CC=1C=CC(=CC1)F