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2-(2,3-Dihydrobenzo[1,4]dioxin-6-ylamino)-N- (2,4-dimethylphenyl)acetamide
SpectraBase Compound ID C9EFPRc4oab
InChI InChI=1S/C18H20N2O3/c1-12-3-5-15(13(2)9-12)20-18(21)11-19-14-4-6-16-17(10-14)23-8-7-22-16/h3-6,9-10,19H,7-8,11H2,1-2H3,(H,20,21)
InChIKey KFIMTLNAHHRHNQ-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C18H20N2O3
Exact Mass 312.147393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B4vPCXH6E79
Name 2-(2,3-Dihydrobenzo[1,4]dioxin-6-ylamino)-N- (2,4-dimethylphenyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 312.147392509 u
Formula C18H20N2O3
InChI InChI=1S/C18H20N2O3/c1-12-3-5-15(13(2)9-12)20-18(21)11-19-14-4-6-16-17(10-14)23-8-7-22-16/h3-6,9-10,19H,7-8,11H2,1-2H3,(H,20,21)
InChIKey KFIMTLNAHHRHNQ-UHFFFAOYSA-N
Molecular Weight 312.369 g/mol
SMILES C12=C(C=C(C=C2)NCC(NC2=C(C=C(C=C2)C)C)=O)OCCO1