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(4S)-1-[4-[(4S)-2-keto-5-methyl-4-phenyl-1,5-diazocan-1-yl]butyl]-5-methyl-4-phenyl-1,5-diazocan-2-one

View entire compound with spectra: 1 MS (GC)

(4S)-1-[4-[(4S)-2-keto-5-methyl-4-phenyl-1,5-diazocan-1-yl]butyl]-5-methyl-4-phenyl-1,5-diazocan-2-one
SpectraBase Compound ID 38kUKSBsxhW
InChI InChI=1S/C30H42N4O2/c1-31-17-11-21-33(29(35)23-27(31)25-13-5-3-6-14-25)19-9-10-20-34-22-12-18-32(2)28(24-30(34)36)26-15-7-4-8-16-26/h3-8,13-16,27-28H,9-12,17-24H2,1-2H3/t27-,28-/m0/s1
InChIKey LNCIXDIFZNXBDP-NSOVKSMOSA-N
Mol Weight 490.7 g/mol
Molecular Formula C30H42N4O2
Exact Mass 490.330777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EzDt7NRm2OL
Name (4S)-1-[4-[(4S)-2-keto-5-methyl-4-phenyl-1,5-diazocan-1-yl]butyl]-5-methyl-4-phenyl-1,5-diazocan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H42N4O2
InChI InChI=1S/C30H42N4O2/c1-31-17-11-21-33(29(35)23-27(31)25-13-5-3-6-14-25)19-9-10-20-34-22-12-18-32(2)28(24-30(34)36)26-15-7-4-8-16-26/h3-8,13-16,27-28H,9-12,17-24H2,1-2H3/t27-,28-/m0/s1
InChIKey LNCIXDIFZNXBDP-NSOVKSMOSA-N
Molecular Weight 490.692 g/mol
SMILES C1C(N(CCCN([C@@]1(c1ccccc1)[H])C)CCCCN1C(C[C@@](c2ccccc2)(N(CCC1)C)[H])=O)=O
SPLASH splash10-052f-0511900000-9eaf34d8bc61aaf7919f
Source of Spectrum AJ-68-3127-1
Synonyms (4S)-5-methyl-1-[4-[(4S)-5-methyl-2-oxidanylidene-4-phenyl-1,5-diazocan-1-yl]butyl]-4-phenyl-1,5-diazocan-2-one (4S)-5-methyl-1-[4-[(4S)-5-methyl-2-oxo-4-phenyl-1,5-diazocan-1-yl]butyl]-4-phenyl-1,5-diazocan-2-one
Wiley ID 773320