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N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-9H-xanthene-9-carboxamide
SpectraBase Compound ID 6FqApWRb2wJ
InChI InChI=1S/C22H23N3O2/c1-14-18(15(2)25(4)23-14)13-24(3)22(26)21-16-9-5-7-11-19(16)27-20-12-8-6-10-17(20)21/h5-12,21H,13H2,1-4H3
InChIKey QMMJBGXVWOAXFF-UHFFFAOYSA-N
Mol Weight 361.45 g/mol
Molecular Formula C22H23N3O2
Exact Mass 361.179027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3n9DzsCeP0s
Name N-Methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-9H-xanthene-9-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 361.179026991 u
Formula C22H23N3O2
InChI InChI=1S/C22H23N3O2/c1-14-18(15(2)25(4)23-14)13-24(3)22(26)21-16-9-5-7-11-19(16)27-20-12-8-6-10-17(20)21/h5-12,21H,13H2,1-4H3
InChIKey QMMJBGXVWOAXFF-UHFFFAOYSA-N
Molecular Weight 361.445 g/mol
SMILES C1(=C(N(C)N=C1C)C)CN(C)C(C1C2=C(C=CC=C2)OC2=C1C=CC=C2)=O