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N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(hydrazinocarbonyl)ethenyl]-2-methoxybenzamide
SpectraBase Compound ID 67flPTOslAI
InChI InChI=1S/C18H17N3O5/c1-24-14-5-3-2-4-12(14)17(22)20-13(18(23)21-19)8-11-6-7-15-16(9-11)26-10-25-15/h2-9H,10,19H2,1H3,(H,20,22)(H,21,23)/b13-8-
InChIKey YBQHXUPIJDEEQH-JYRVWZFOSA-N
Mol Weight 355.35 g/mol
Molecular Formula C18H17N3O5
Exact Mass 355.116821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KtNLleahVq7
Name N-[(Z)-2-(1,3-Benzodioxol-5-yl)-1-(hydrazinocarbonyl)ethenyl]-2-methoxybenzamide
Comments Computed using HOSE algorithm
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Exact Mass 355.116820654 u
Formula C18H17N3O5
InChI InChI=1S/C18H17N3O5/c1-24-14-5-3-2-4-12(14)17(22)20-13(18(23)21-19)8-11-6-7-15-16(9-11)26-10-25-15/h2-9H,10,19H2,1H3,(H,20,22)(H,21,23)/b13-8-
InChIKey YBQHXUPIJDEEQH-JYRVWZFOSA-N
Molecular Weight 355.350 g/mol
SMILES N(\C(C(=O)NN)=C/C1=CC=2OCOC2C=C1)C(C=1C(OC)=CC=CC1)=O