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(E)-(1-benzylpyrazol-4-yl)methylene-methoxy-amine
SpectraBase Compound ID KMMVHfEd3Oz
InChI InChI=1S/C12H13N3O/c1-16-14-8-12-7-13-15(10-12)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3/b14-8+
InChIKey YXHNTPGYVNTWHQ-RIYZIHGNSA-N
Mol Weight 215.26 g/mol
Molecular Formula C12H13N3O
Exact Mass 215.105862 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9BUutaNWzaM
Name (E)-(1-Benzylpyrazol-4-yl)methylene-methoxy-amine
Comments Computed using HOSE algorithm
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Exact Mass 215.105862050 u
Formula C12H13N3O
InChI InChI=1S/C12H13N3O/c1-16-14-8-12-7-13-15(10-12)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3/b14-8+
InChIKey YXHNTPGYVNTWHQ-RIYZIHGNSA-N
Molecular Weight 215.256 g/mol
SMILES C1=NN(C=C1\C=N\OC)CC1=CC=CC=C1