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Methyl 2-([(E)-[(4-bromophenyl)imino](phenyl)methyl]oxy)-5-chlorobenzoate
SpectraBase Compound ID 2XbMUQsxxYN
InChI InChI=1S/C21H15BrClNO3/c1-26-21(25)18-13-16(23)9-12-19(18)27-20(14-5-3-2-4-6-14)24-17-10-7-15(22)8-11-17/h2-13H,1H3/b24-20+
InChIKey RPQPGKLFZKZFJF-HIXSDJFHSA-N
Mol Weight 444.71 g/mol
Molecular Formula C21H15BrClNO3
Exact Mass 442.992384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8M4R9K066Tg
Name Methyl 2-([(E)-[(4-bromophenyl)imino](phenyl)methyl]oxy)-5-chlorobenzoate
Alternate Name(s) Benzoic acid, 2-[[(4-bromophenyl)imino]phenylmethoxy]-5-chloro-, methyl ester
CAS Registry Number 77774-23-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15BrClNO3
InChI InChI=1S/C21H15BrClNO3/c1-26-21(25)18-13-16(23)9-12-19(18)27-20(14-5-3-2-4-6-14)24-17-10-7-15(22)8-11-17/h2-13H,1H3/b24-20+
InChIKey RPQPGKLFZKZFJF-HIXSDJFHSA-N
Molecular Weight 444.712 g/mol
SMILES COC(=O)c1c(O\C(=N\c2ccc(Br)cc2)c2ccccc2)ccc(Cl)c1
SPLASH splash10-0bt9-4490000000-a5f8f84c7e3be04b2df7
Source of Spectrum W5-1989-3296-1
Wiley ID 1385688