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1,2-Dimethyl-5-(4-isopropyl-phenyl)-2,3-dihydro-1,2,4-triazol-3-one

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1,2-Dimethyl-5-(4-isopropyl-phenyl)-2,3-dihydro-1,2,4-triazol-3-one
SpectraBase Compound ID 4i1hJcnjW6R
InChI InChI=1S/C13H17N3O/c1-9(2)10-5-7-11(8-6-10)12-14-13(17)16(4)15(12)3/h5-9H,1-4H3
InChIKey CVWYDEHGSCTWBE-UHFFFAOYSA-N
Mol Weight 231.3 g/mol
Molecular Formula C13H17N3O
Exact Mass 231.137162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2eBObVp3IXB
Name 1,2-Dimethyl-5-(4-isopropyl-phenyl)-2,3-dihydro-1,2,4-triazol-3-one
CAS Registry Number 59811-97-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17N3O
InChI InChI=1S/C13H17N3O/c1-9(2)10-5-7-11(8-6-10)12-14-13(17)16(4)15(12)3/h5-9H,1-4H3
InChIKey CVWYDEHGSCTWBE-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference W.M. Litchman, U. Hollstein, Org. Magn. Resonance 11, 137 (1978).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6