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2H-1-Benzopyran-2-one, 3,4-dimethyl-7-[[1-methyl-5-(1-methylethyl)-1H-pyrazol-3-yl]methoxy]-
SpectraBase Compound ID IOTUJDx37jt
InChI InChI=1S/C19H22N2O3/c1-11(2)17-8-14(20-21(17)5)10-23-15-6-7-16-12(3)13(4)19(22)24-18(16)9-15/h6-9,11H,10H2,1-5H3
InChIKey DWDZHZWCNWABRT-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C19H22N2O3
Exact Mass 326.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JgJcSRC7rkV
Name 2H-1-Benzopyran-2-one, 3,4-dimethyl-7-[[1-methyl-5-(1-methylethyl)-1H-pyrazol-3-yl]methoxy]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.163042573 u
Formula C19H22N2O3
InChI InChI=1S/C19H22N2O3/c1-11(2)17-8-14(20-21(17)5)10-23-15-6-7-16-12(3)13(4)19(22)24-18(16)9-15/h6-9,11H,10H2,1-5H3
InChIKey DWDZHZWCNWABRT-UHFFFAOYSA-N
Molecular Weight 326.396 g/mol
SMILES C1(=C(C(OC=2C=C(C=CC12)OCC=1C=C(N(N1)C)C(C)C)=O)C)C