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5-Keto-5-[4-[(5-keto-5-methoxy-pentanoyl)amino]butylamino]valeric acid methyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

5-Keto-5-[4-[(5-keto-5-methoxy-pentanoyl)amino]butylamino]valeric acid methyl ester
SpectraBase Compound ID gYaOP6q4qc
InChI InChI=1S/C16H28N2O6/c1-23-15(21)9-5-7-13(19)17-11-3-4-12-18-14(20)8-6-10-16(22)24-2/h3-12H2,1-2H3,(H,17,19)(H,18,20)
InChIKey AFCINSNXFLEVNR-UHFFFAOYSA-N
Mol Weight 344.41 g/mol
Molecular Formula C16H28N2O6
Exact Mass 344.194737 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KMjTKqE6sbp
Name 5-Keto-5-[4-[(5-keto-5-methoxy-pentanoyl)amino]butylamino]valeric acid methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.194736624 u
Formula C16H28N2O6
InChI InChI=1S/C16H28N2O6/c1-23-15(21)9-5-7-13(19)17-11-3-4-12-18-14(20)8-6-10-16(22)24-2/h3-12H2,1-2H3,(H,17,19)(H,18,20)
InChIKey AFCINSNXFLEVNR-UHFFFAOYSA-N
Molecular Weight 344.408 g/mol
SMILES C(=O)(NCCCCNC(=O)CCCC(=O)OC)CCCC(=O)OC