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2-(1,3-benzodioxol-5-yl)-9-chloro-5-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
SpectraBase Compound ID 5IOF9FSEKPy
InChI InChI=1S/C25H21ClN2O4/c1-2-29-18-7-3-15(4-8-18)25-28-21(19-12-17(26)6-10-22(19)32-25)13-20(27-28)16-5-9-23-24(11-16)31-14-30-23/h3-12,21,25H,2,13-14H2,1H3
InChIKey YFVWOIWAXGDSFA-UHFFFAOYSA-N
Mol Weight 448.91 g/mol
Molecular Formula C25H21ClN2O4
Exact Mass 448.118985 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8RF2x2dZ4ax
Name 2-(1,3-benzodioxol-5-yl)-9-chloro-5-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H21ClN2O4/c1-2-29-18-7-3-15(4-8-18)25-28-21(19-12-17(26)6-10-22(19)32-25)13-20(27-28)16-5-9-23-24(11-16)31-14-30-23/h3-12,21,25H,2,13-14H2,1H3
InChIKey YFVWOIWAXGDSFA-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13639
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D88427; Labnumber: ExRud-02768; SBI_ID: SBI-013642
Synonyms 4-[2-(1,3-benzodioxol-5-yl)-9-chloro-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl ethyl ether
Temperature 300 °C