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3-Amino-2-[2-(3,4-diethoxyphenyl)-1-oxoethyl]-1-cyclohex-2-enone
SpectraBase Compound ID G0fhOvvSp9Q
InChI InChI=1S/C18H23NO4/c1-3-22-16-9-8-12(11-17(16)23-4-2)10-15(21)18-13(19)6-5-7-14(18)20/h8-9,11H,3-7,10,19H2,1-2H3
InChIKey PXYRSYISZDPBQY-UHFFFAOYSA-N
Mol Weight 317.38 g/mol
Molecular Formula C18H23NO4
Exact Mass 317.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoQSGjLOMD0
Name 3-Amino-2-[2-(3,4-diethoxyphenyl)-1-oxoethyl]-1-cyclohex-2-enone
Alternate Name(s) 3-Amino-2-[2-(3,4-diethoxyphenyl)acetyl]cyclohex-2-en-1-one 3-Azanyl-2-[2-(3,4-diethoxyphenyl)ethanoyl]cyclohex-2-en-1-one Cyclohex-2-enone, 3-amino-2-[2-(3,4-diethoxyphenyl)acetyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO4
InChI InChI=1S/C18H23NO4/c1-3-22-16-9-8-12(11-17(16)23-4-2)10-15(21)18-13(19)6-5-7-14(18)20/h8-9,11H,3-7,10,19H2,1-2H3
InChIKey PXYRSYISZDPBQY-UHFFFAOYSA-N
Molecular Weight 317.385 g/mol
SMILES NC1=C(C(Cc2cc(OCC)c(cc2)OCC)=O)C(=O)CCC1
SPLASH splash10-000i-7900000000-5a905db3160f77208fab
Wiley ID 1446255