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2-(p-nitrophenyl)-2,3,3a,4-tetrahydro[1]benzopyrano[4,3-c]pyrazole-3-carboxylic acid, ethyl ester
SpectraBase Compound ID J0kssr673Ad
InChI InChI=1S/C19H17N3O5/c1-2-26-19(23)18-15-11-27-16-6-4-3-5-14(16)17(15)20-21(18)12-7-9-13(10-8-12)22(24)25/h3-10,15,18H,2,11H2,1H3
InChIKey MZFLKXSXWFDIAT-UHFFFAOYSA-N
Mol Weight 367.36 g/mol
Molecular Formula C19H17N3O5
Exact Mass 367.116821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3KoCC83kNOi
Name 2-(p-NITROPHENYL)-2,3,3a,4-TETRAHYDRO[1]BENZOPYRANO[4,3-c]PYRAZOLE-3-CARBOXYLIC ACID, ETHYL ESTER
Source of Sample T. Shimizu, Kyoto Technical University, Kyoto, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17N3O5
InChI InChI=1S/C19H17N3O5/c1-2-26-19(23)18-15-11-27-16-6-4-3-5-14(16)17(15)20-21(18)12-7-9-13(10-8-12)22(24)25/h3-10,15,18H,2,11H2,1H3
InChIKey MZFLKXSXWFDIAT-UHFFFAOYSA-N
Melting Point 165-166C
Molecular Weight 367.36
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms [1]BENZOPYRANO[4,3-C]YRAZOLE- 3-CARBOXYLIC ACID, 2-/P-NITROPHENYL/-2,3,3A,4-TETRAHYDRO-, ETHYL ESTER