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3-phenyl-2-(phenylsulfonyl)-2,3,3a,4-tetrahydro[1]benzopyrano[4,3-c]pyrazole

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3-phenyl-2-(phenylsulfonyl)-2,3,3a,4-tetrahydro[1]benzopyrano[4,3-c]pyrazole
SpectraBase Compound ID FZryPyFufNS
InChI InChI=1S/C22H18N2O3S/c25-28(26,17-11-5-2-6-12-17)24-22(16-9-3-1-4-10-16)19-15-27-20-14-8-7-13-18(20)21(19)23-24/h1-14,19,22H,15H2
InChIKey ZWQHEWVGKHONHR-UHFFFAOYSA-N
Mol Weight 390.46 g/mol
Molecular Formula C22H18N2O3S
Exact Mass 390.103814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FJfOU705sCW
Name 3-PHENYL-2-(PHENYLSULFONYL)-2,3,3a,4-TETRAHYDRO[1]BENZOPYRANO[4,3-c]PYRAZOLE
Source of Sample T. Shimizu, Kyoto Technical University, Kyoto, Japan
Comments Tentative assignment; One carbon atom is unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N2O3S
InChI InChI=1S/C22H18N2O3S/c25-28(26,17-11-5-2-6-12-17)24-22(16-9-3-1-4-10-16)19-15-27-20-14-8-7-13-18(20)21(19)23-24/h1-14,19,22H,15H2
InChIKey ZWQHEWVGKHONHR-UHFFFAOYSA-N
Melting Point 206-210C
Molecular Weight 390.46
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms [1]BENZOPYRANO[4,3-C]PYRAZOLE, 3-PHENYL-2-/PHENYLSULFONYL/-2,3,3A,4-TETRAHYDRO-,