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5-(4'-Acetamidobutyl)-1-acetyl-1,5-diaza-16,17-dideuteriocyclohenicosane-6,15-dione
SpectraBase Compound ID eGCl6NJbfU
InChI InChI=1S/C27H49N3O4/c1-24(31)28-19-12-14-21-30-23-15-22-29(25(2)32)20-13-8-7-10-17-26(33)16-9-5-3-4-6-11-18-27(30)34/h3-23H2,1-2H3,(H,28,31)/i10D,17D
InChIKey UPRQZOQFPOCMSF-JPIBBHLBSA-N
Mol Weight 481.7 g/mol
Molecular Formula C27H472D2N3O4
Exact Mass 481.384861 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKXm5hmNsrI
Name 5-(4'-Acetamidobutyl)-1-acetyl-1,5-diaza-16,17-dideuteriocyclohenicosane-6,15-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H47D2N3O4
InChI InChI=1S/C27H49N3O4/c1-24(31)28-19-12-14-21-30-23-15-22-29(25(2)32)20-13-8-7-10-17-26(33)16-9-5-3-4-6-11-18-27(30)34/h3-23H2,1-2H3,(H,28,31)/i10D,17D
InChIKey UPRQZOQFPOCMSF-JPIBBHLBSA-N
Molecular Weight 481.718 g/mol
SMILES N(C(=O)C)CCCCN1C(=O)CCCCCCCCC(=O)C(C(CCCCN(CCC1)C(=O)C)[2D])[2D]
SPLASH splash10-029i-4914500000-f64396d1c2118a4152fc
Source of Spectrum H-79-980-13
Wiley ID 1395037