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Benzenepropanamide, N-[4-[acetyl[3-(acetylamino)propyl]amino]butyl]-N-[3-(acetylamino)propyl]-4-(acetyloxy)-
SpectraBase Compound ID 3GfMjaUt5B1
InChI InChI=1S/C27H42N4O6/c1-21(32)28-15-7-19-30(23(3)34)17-5-6-18-31(20-8-16-29-22(2)33)27(36)14-11-25-9-12-26(13-10-25)37-24(4)35/h9-10,12-13H,5-8,11,14-20H2,1-4H3,(H,28,32)(H,29,33)
InChIKey XJHGJFRANKYJIL-UHFFFAOYSA-N
Mol Weight 518.7 g/mol
Molecular Formula C27H42N4O6
Exact Mass 518.310435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqtxB1KQOl9
Name Benzenepropanamide, N-[4-[acetyl[3-(acetylamino)propyl]amino]butyl]-N-[3-(acetylamino)propyl]-4-(acetyloxy)-
CAS Registry Number 42920-02-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42N4O6
InChI InChI=1S/C27H42N4O6/c1-21(32)28-15-7-19-30(23(3)34)17-5-6-18-31(20-8-16-29-22(2)33)27(36)14-11-25-9-12-26(13-10-25)37-24(4)35/h9-10,12-13H,5-8,11,14-20H2,1-4H3,(H,28,32)(H,29,33)
InChIKey XJHGJFRANKYJIL-UHFFFAOYSA-N
Molecular Weight 518.655 g/mol
SMILES N(CCCN(CCCCN(CCCNC(C)=O)C(CCc1ccc(cc1)OC(C)=O)=O)C(C)=O)C(C)=O
SPLASH splash10-0a4i-8910000000-4c68400efc4d4a8e3769
Source of Spectrum H-56-1284-7
Synonyms 4-(3-((4-(Acetyl[3-(acetylamino)propyl]amino)butyl)[3-(acetylamino)propyl]amino)-3-oxopropyl)phenyl acetate Acetic acid [4-[3-[3-acetamidopropyl-[4-[3-acetamidopropyl(acetyl)amino]butyl]amino]-3-oxopropyl]phenyl] ester [4-[3-[3-acetamidopropyl-[4-[3-acetamidopropyl(acetyl)amino]butyl]amino]-3-oxopropyl]phenyl] acetate [4-[3-[3-acetamidopropyl-[4-[3-acetamidopropyl(acetyl)amino]butyl]amino]-3-oxo-propyl]phenyl] acetate [4-[3-[3-acetamidopropyl-[4-[3-acetamidopropyl(ethanoyl)amino]butyl]amino]-3-oxidanylidene-propyl]phenyl] ethanoate
Wiley ID 1401668