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4'-(2-Bromoethyl)acetophenone 2,4-dinitrophenylhydrazone

View entire compound with spectra: 1 FTIR

4'-(2-Bromoethyl)acetophenone 2,4-dinitrophenylhydrazone
SpectraBase Compound ID Czl2bRDmEtw
InChI InChI=1S/C16H15BrN4O4/c1-11(13-4-2-12(3-5-13)8-9-17)18-19-15-7-6-14(20(22)23)10-16(15)21(24)25/h2-7,10,19H,8-9H2,1H3/b18-11+
InChIKey SPMGLAUIMCNQQV-WOJGMQOQSA-N
Mol Weight 407.22 g/mol
Molecular Formula C16H15BrN4O4
Exact Mass 406.027668 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J14vajnb79T
Name 4'-(2-Bromoethyl)acetophenone 2,4-dinitrophenylhydrazone
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 406.027667975 u
Formula C16H15BrN4O4
InChI InChI=1S/C16H15BrN4O4/c1-11(13-4-2-12(3-5-13)8-9-17)18-19-15-7-6-14(20(22)23)10-16(15)21(24)25/h2-7,10,19H,8-9H2,1H3/b18-11+
InChIKey SPMGLAUIMCNQQV-WOJGMQOQSA-N
Molecular Weight 407.224 g/mol
SMILES C1=C(C=CC(=C1)CCBr)\C(=N\NC1=C(C=C(C=C1)N(=O)=O)N(=O)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.921996