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benzenesulfonic acid, 4-fluoro-, 4-(1,2,3,4,5,6-hexahydro-2,2-dimethyl-4-oxobenzo[a]phenanthridin-5-yl)-2-methoxyphenyl ester

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benzenesulfonic acid, 4-fluoro-, 4-(1,2,3,4,5,6-hexahydro-2,2-dimethyl-4-oxobenzo[a]phenanthridin-5-yl)-2-methoxyphenyl ester
SpectraBase Compound ID K8UN9P2cg7n
InChI InChI=1S/C32H28FNO5S/c1-32(2)17-24-29-23-7-5-4-6-19(23)8-14-25(29)34-31(30(24)26(35)18-32)20-9-15-27(28(16-20)38-3)39-40(36,37)22-12-10-21(33)11-13-22/h4-16,31,34H,17-18H2,1-3H3
InChIKey SCFQGIKXYIEBHB-UHFFFAOYSA-N
Mol Weight 557.6 g/mol
Molecular Formula C32H28FNO5S
Exact Mass 557.167222 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FQAXDAOq54O
Name benzenesulfonic acid, 4-fluoro-, 4-(1,2,3,4,5,6-hexahydro-2,2-dimethyl-4-oxobenzo[a]phenanthridin-5-yl)-2-methoxyphenyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 557.167222338 u
Formula C32H28FNO5S
InChI InChI=1S/C32H28FNO5S/c1-32(2)17-24-29-23-7-5-4-6-19(23)8-14-25(29)34-31(30(24)26(35)18-32)20-9-15-27(28(16-20)38-3)39-40(36,37)22-12-10-21(33)11-13-22/h4-16,31,34H,17-18H2,1-3H3
InChIKey SCFQGIKXYIEBHB-UHFFFAOYSA-N
Molecular Weight 557.636 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_564
Solvent DMSO-d6
Source Vendor ID: ZI/7107705; Lab Number: SAD-e000075
Temperature 29.85 °C