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3-{4-[2-(2-Bromo-4,5-dimethoxyphenyl)ethylamino]butyl}cyclopent-2-enyl acetate
SpectraBase Compound ID oKmc2G6dp1
InChI InChI=1S/C21H30BrNO4/c1-15(24)27-18-8-7-16(12-18)6-4-5-10-23-11-9-17-13-20(25-2)21(26-3)14-19(17)22/h12-14,18,23H,4-11H2,1-3H3
InChIKey DGBDJUJBLDVNHR-UHFFFAOYSA-N
Mol Weight 440.38 g/mol
Molecular Formula C21H30BrNO4
Exact Mass 439.135821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hrl6GbizGkr
Name 3-{4-[2-(2-Bromo-4,5-dimethoxyphenyl)ethylamino]butyl}cyclopent-2-enyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30BrNO4
InChI InChI=1S/C21H30BrNO4/c1-15(24)27-18-8-7-16(12-18)6-4-5-10-23-11-9-17-13-20(25-2)21(26-3)14-19(17)22/h12-14,18,23H,4-11H2,1-3H3
InChIKey DGBDJUJBLDVNHR-UHFFFAOYSA-N
Molecular Weight 440.378 g/mol
SMILES N(CCc1c(cc(c(c1)OC)OC)Br)CCCCC1=CC(OC(=O)C)CC1
SPLASH splash10-0udi-1910000000-6baaf738500536fd53e5
Source of Spectrum QE-6-514-12
Synonyms 3-(4-{[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]amino}butyl)-2-cyclopenten-1-yl acetate
Wiley ID 844556