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Trans-3-[bis(2-chloroethyl)amino]-2',4',5'-trimethylacrylophenone

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 1 UV-Vis

Trans-3-[bis(2-chloroethyl)amino]-2',4',5'-trimethylacrylophenone
SpectraBase Compound ID KFiz8IC0EJI
InChI InChI=1S/C16H21Cl2NO/c1-12-10-14(3)15(11-13(12)2)16(20)4-7-19(8-5-17)9-6-18/h4,7,10-11H,5-6,8-9H2,1-3H3/b7-4+
InChIKey QLTPHMHICKVYAP-QPJJXVBHSA-N
Mol Weight 314.26 g/mol
Molecular Formula C16H21Cl2NO
Exact Mass 313.10002 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DFcPfT0eBSD
Name trans-3-[BIS(2-CHLOROETHYL)AMINO]-2',4',5'-TRIMETHYLACRYLOPHENONE
Source of Sample G. W. Fischer, Academy of Sciences, Leipzig, Germany
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21Cl2NO
InChI InChI=1S/C16H21Cl2NO/c1-12-10-14(3)15(11-13(12)2)16(20)4-7-19(8-5-17)9-6-18/h4,7,10-11H,5-6,8-9H2,1-3H3/b7-4+
InChIKey QLTPHMHICKVYAP-QPJJXVBHSA-N
Melting Point 108C
Molecular Weight 314.26
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACRYLOPHENONE, 3-/BIS/2-CHLOROETHYL/AMINO/-2',4',5'-TRIMETHYL-, trans-,