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Ethyl 5-bromo-3-(4-fluorobenzoyl)-4-formylthiophene-2-carboxylate
SpectraBase Compound ID JWXnWRtpnYg
InChI InChI=1S/C15H10BrFO4S/c1-2-21-15(20)13-11(10(7-18)14(16)22-13)12(19)8-3-5-9(17)6-4-8/h3-7H,2H2,1H3
InChIKey SFQWDJRQGZXMRM-UHFFFAOYSA-N
Mol Weight 385.2 g/mol
Molecular Formula C15H10BrFO4S
Exact Mass 383.946721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wjPR0RxSct
Name Ethyl 5-bromo-3-(4-fluorobenzoyl)-4-formylthiophene-2-carboxylate
Appearance Yellow oil
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Formula C15H10BrFO4S
InChI InChI=1S/C15H10BrFO4S/c1-2-21-15(20)13-11(10(7-18)14(16)22-13)12(19)8-3-5-9(17)6-4-8/h3-7H,2H2,1H3
InChIKey SFQWDJRQGZXMRM-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500627
Molecular Weight 385.203 g/mol
Quality 454
Reported Formula C15H10BrFO4S
SMILES C(C)OC(=O)C=1SC(=C(C1C(C1=CC=C(C=C1)F)=O)C=O)Br
SPLASH splash10-007t-6439000000-8d7e12577c7bafcc8edf
Source of Spectrum QE-21-SM35-14a (DOI: 10.1002/chem.201500627)
Wiley ID 1906506