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2-methoxy-N-methyl-5-{[4-(4-methyl-3-{[(tetrahydro-2-furanylmethyl)amino]sulfonyl}phenyl)-1-phthalazinyl]amino}benzamide
SpectraBase Compound ID 3WHGxNqnCE2
InChI InChI=1S/C29H31N5O5S/c1-18-10-11-19(15-26(18)40(36,37)31-17-21-7-6-14-39-21)27-22-8-4-5-9-23(22)28(34-33-27)32-20-12-13-25(38-3)24(16-20)29(35)30-2/h4-5,8-13,15-16,21,31H,6-7,14,17H2,1-3H3,(H,30,35)(H,32,34)
InChIKey NQPKKRPDFZYZDO-UHFFFAOYSA-N
Mol Weight 561.66 g/mol
Molecular Formula C29H31N5O5S
Exact Mass 561.20459 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 983SwkS7Nax
Name 2-methoxy-N-methyl-5-{[4-(4-methyl-3-{[(tetrahydro-2-furanylmethyl)amino]sulfonyl}phenyl)-1-phthalazinyl]amino}benzamide
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/C29H31N5O5S/c1-18-10-11-19(15-26(18)40(36,37)31-17-21-7-6-14-39-21)27-22-8-4-5-9-23(22)28(34-33-27)32-20-12-13-25(38-3)24(16-20)29(35)30-2/h4-5,8-13,15-16,21,31H,6-7,14,17H2,1-3H3,(H,30,35)(H,32,34)
InChIKey NQPKKRPDFZYZDO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14949
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: C26469; Labnumber: RRAZ1-2338; SBI_ID: SBI-014952
Temperature 313 °C