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13-(3-chloro-2-methylphenyl)-10,11-dihydro-9H-9,10-[3,4]epipyrroloanthracene-12,14(13H,15H)-dione
SpectraBase Compound ID B3pT1PxQIKZ
InChI InChI=1S/C25H18ClNO2/c1-13-18(26)11-6-12-19(13)27-24(28)22-20-14-7-2-3-8-15(14)21(23(22)25(27)29)17-10-5-4-9-16(17)20/h2-12,20-23H,1H3/t20-,21+,22-,23+
InChIKey MQZKLWYPDQKPEV-MESAYYPLSA-N
Mol Weight 399.88 g/mol
Molecular Formula C25H18ClNO2
Exact Mass 399.102607 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LLQxXkNGqtB
Name 13-(3-chloro-2-methylphenyl)-10,11-dihydro-9H-9,10-[3,4]epipyrroloanthracene-12,14(13H,15H)-dione
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/C25H18ClNO2/c1-13-18(26)11-6-12-19(13)27-24(28)22-20-14-7-2-3-8-15(14)21(23(22)25(27)29)17-10-5-4-9-16(17)20/h2-12,20-23H,1H3/t20-,21+,22-,23+
InChIKey MQZKLWYPDQKPEV-MESAYYPLSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_2678
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: NMR/10218138