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3-methoxy-4-(1'-(methylsulfonyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-2-yl)phenol
SpectraBase Compound ID KuuJUwznMhG
InChI InChI=1S/C22H25N3O5S/c1-29-21-13-15(26)7-8-16(21)18-14-19-17-5-3-4-6-20(17)30-22(25(19)23-18)9-11-24(12-10-22)31(2,27)28/h3-8,13,19,26H,9-12,14H2,1-2H3
InChIKey JMQNSVDDWHJXBM-UHFFFAOYSA-N
Mol Weight 443.52 g/mol
Molecular Formula C22H25N3O5S
Exact Mass 443.151492 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ERp7uOBuPKv
Name 3-methoxy-4-(1'-(methylsulfonyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-2-yl)phenol
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/C22H25N3O5S/c1-29-21-13-15(26)7-8-16(21)18-14-19-17-5-3-4-6-20(17)30-22(25(19)23-18)9-11-24(12-10-22)31(2,27)28/h3-8,13,19,26H,9-12,14H2,1-2H3
InChIKey JMQNSVDDWHJXBM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22141
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: D58689; Labnumber: GELNC-622; SBI_ID: SBI-022145
Temperature 315 °C