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4-(Cyclohexylamino)-3-(4-nitrophenyl)-4-oxobutanoic acid

View entire compound with spectra: 1 MS (GC)

4-(Cyclohexylamino)-3-(4-nitrophenyl)-4-oxobutanoic acid
SpectraBase Compound ID C5BkKWpPYXL
InChI InChI=1S/C16H20N2O5/c19-15(20)10-14(11-6-8-13(9-7-11)18(22)23)16(21)17-12-4-2-1-3-5-12/h6-9,12,14H,1-5,10H2,(H,17,21)(H,19,20)
InChIKey HSIFLBSPKBSWFH-UHFFFAOYSA-N
Mol Weight 320.34 g/mol
Molecular Formula C16H20N2O5
Exact Mass 320.137222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4NQEybRCeC4
Name 4-(Cyclohexylamino)-3-(4-nitrophenyl)-4-oxobutanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O5
InChI InChI=1S/C16H20N2O5/c19-15(20)10-14(11-6-8-13(9-7-11)18(22)23)16(21)17-12-4-2-1-3-5-12/h6-9,12,14H,1-5,10H2,(H,17,21)(H,19,20)
InChIKey HSIFLBSPKBSWFH-UHFFFAOYSA-N
Molecular Weight 320.345 g/mol
SMILES N(C(C(CC(=O)O)c1ccc(N(=O)=O)cc1)=O)C1CCCCC1
SPLASH splash10-0feb-4904000000-1095ea3d538078af1faa
Source of Spectrum CV-0-434-4
Wiley ID 849336