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1H-cyclopenta[c]quinoline, 1,6,8-trichloro-2,3,3a,4,5,9b-hexahydro-4-(4-nitrophenyl)-2-[(2-nitrophenyl)thio]-
SpectraBase Compound ID 7nsC4MvIzCD
InChI InChI=1S/C24H18Cl3N3O4S/c25-13-9-15-21-16(11-20(22(21)27)35-19-4-2-1-3-18(19)30(33)34)23(28-24(15)17(26)10-13)12-5-7-14(8-6-12)29(31)32/h1-10,16,20-23,28H,11H2
InChIKey VDAIXJBXHUVLFU-UHFFFAOYSA-N
Mol Weight 550.84 g/mol
Molecular Formula C24H18Cl3N3O4S
Exact Mass 549.00836 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3WqRXTGaJoS
Name 1H-cyclopenta[c]quinoline, 1,6,8-trichloro-2,3,3a,4,5,9b-hexahydro-4-(4-nitrophenyl)-2-[(2-nitrophenyl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 549.008360342 u
Formula C24H18Cl3N3O4S
InChI InChI=1S/C24H18Cl3N3O4S/c25-13-9-15-21-16(11-20(22(21)27)35-19-4-2-1-3-18(19)30(33)34)23(28-24(15)17(26)10-13)12-5-7-14(8-6-12)29(31)32/h1-10,16,20-23,28H,11H2
InChIKey VDAIXJBXHUVLFU-UHFFFAOYSA-N
Molecular Weight 550.844 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1041
Solvent DMSO-d6
Source Vendor ID: ZI/8030854; Lab Info: BOS; Lab Number: BOS-aen3111
Temperature 23.85 °C