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2-Phenylamino-4-(diethoxy)methyl-5-benzoylthiazole

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-Phenylamino-4-(diethoxy)methyl-5-benzoylthiazole
SpectraBase Compound ID 4RV2Gx3LPSN
InChI InChI=1S/C21H22N2O3S/c1-3-25-20(26-4-2)17-19(18(24)15-11-7-5-8-12-15)27-21(23-17)22-16-13-9-6-10-14-16/h5-14,20H,3-4H2,1-2H3,(H,22,23)
InChIKey DAHITQASLKGDJJ-UHFFFAOYSA-N
Mol Weight 382.48 g/mol
Molecular Formula C21H22N2O3S
Exact Mass 382.135114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DveSxgX68GP
Name 2-Phenylamino-4-(diethoxy)methyl-5-benzoylthiazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.135113747 u
Formula C21H22N2O3S
InChI InChI=1S/C21H22N2O3S/c1-3-25-20(26-4-2)17-19(18(24)15-11-7-5-8-12-15)27-21(23-17)22-16-13-9-6-10-14-16/h5-14,20H,3-4H2,1-2H3,(H,22,23)
InChIKey DAHITQASLKGDJJ-UHFFFAOYSA-N
Molecular Weight 382.478 g/mol
SMILES C1(=C(N=C(S1)NC=1C=CC=CC1)C(OCC)OCC)C(=O)C=1C=CC=CC1