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4-(3-Bromo-4-ethoxy-5-methoxy-phenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
SpectraBase Compound ID EQ51s8WaLV4
InChI InChI=1S/C21H21BrN2O4/c1-3-28-21-17(22)9-12(10-19(21)27-2)20-15-6-4-5-14(15)16-11-13(24(25)26)7-8-18(16)23-20/h4-5,7-11,14-15,20,23H,3,6H2,1-2H3
InChIKey PRULTHQJMVFROH-UHFFFAOYSA-N
Mol Weight 445.31 g/mol
Molecular Formula C21H21BrN2O4
Exact Mass 444.06847 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41bScIVZcOe
Name 4-(3-Bromo-4-ethoxy-5-methoxy-phenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Alternate Name(s) 4-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21BrN2O4
InChI InChI=1S/C21H21BrN2O4/c1-3-28-21-17(22)9-12(10-19(21)27-2)20-15-6-4-5-14(15)16-11-13(24(25)26)7-8-18(16)23-20/h4-5,7-11,14-15,20,23H,3,6H2,1-2H3
InChIKey PRULTHQJMVFROH-UHFFFAOYSA-N
Molecular Weight 445.313 g/mol
SMILES N1c2c(C3C=CCC3C1c1cc(Br)c(c(c1)OC)OCC)cc(cc2)N(=O)=O
SPLASH splash10-014i-4950000000-fc32318bc68e33189fee
Wiley ID 1454972