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N-(3,5-dichloro-4-hydroxyphenyl)-2-(1H-tetraazol-1-yl)acetamide
SpectraBase Compound ID GNrawXSiH0E
InChI InChI=1S/C9H7Cl2N5O2/c10-6-1-5(2-7(11)9(6)18)13-8(17)3-16-4-12-14-15-16/h1-2,4,18H,3H2,(H,13,17)
InChIKey ZHQSMALWKZMIHQ-UHFFFAOYSA-N
Mol Weight 288.09 g/mol
Molecular Formula C9H7Cl2N5O2
Exact Mass 286.99768 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JNz4DximEt2
Name N-(3,5-Dichloro-4-hydroxyphenyl)-2-(1H-tetraazol-1-yl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.997679883 u
Formula C9H7Cl2N5O2
InChI InChI=1S/C9H7Cl2N5O2/c10-6-1-5(2-7(11)9(6)18)13-8(17)3-16-4-12-14-15-16/h1-2,4,18H,3H2,(H,13,17)
InChIKey ZHQSMALWKZMIHQ-UHFFFAOYSA-N
SMILES OC1=C(C=C(NC(CN2N=NN=C2)=O)C=C1Cl)Cl