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3-(1H-Imidazol-1-yl)-1-phenylpropyl-2,4-dichlorobenzoate
SpectraBase Compound ID 28Zc7jhdGgD
InChI InChI=1S/C19H16Cl2N2O2/c20-15-6-7-16(17(21)12-15)19(24)25-18(14-4-2-1-3-5-14)8-10-23-11-9-22-13-23/h1-7,9,11-13,18H,8,10H2
InChIKey JJSSKQLCQDSKDR-UHFFFAOYSA-N
Mol Weight 375.26 g/mol
Molecular Formula C19H16Cl2N2O2
Exact Mass 374.058883 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID w5sgkfcone
Name 3-(1H-Imidazol-1-yl)-1-phenylpropyl-2,4-dichlorobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16Cl2N2O2
InChI InChI=1S/C19H16Cl2N2O2/c20-15-6-7-16(17(21)12-15)19(24)25-18(14-4-2-1-3-5-14)8-10-23-11-9-22-13-23/h1-7,9,11-13,18H,8,10H2
InChIKey JJSSKQLCQDSKDR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201000224
Molecular Weight 375.255 g/mol
SMILES c1cc(C(CC[n]2ccnc2)OC(=O)c2ccc(cc2Cl)Cl)ccc1
SPLASH splash10-0udi-3290000000-8413d27a09196d658860
Source of Spectrum APC-344-799-5c
Synonyms 3-(1H-imidazol-1-yl)-1-phenylpropyl 2,4-dichlorobenzoate 2,4-Dichlorobenzoic acid [3-(1-imidazolyl)-1-phenylpropyl] ester (3-imidazol-1-yl-1-phenylpropyl) 2,4-dichlorobenzoate (3-imidazol-1-yl-1-phenyl-propyl) 2,4-dichlorobenzoate (3-imidazol-1-yl-1-phenyl-propyl) 2,4-bis(chloranyl)benzoate
Wiley ID 1769175