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L-LEUCINE, N-[N-[N-[(PHENYLMETHOXY)CARBONYL]-L-LEUCYL]-L-LEUCYL]-, METHYL ESTER
SpectraBase Compound ID Cxnxcf5FnOQ
InChI InChI=1S/C27H43N3O6/c1-17(2)13-21(24(31)29-23(15-19(5)6)26(33)35-7)28-25(32)22(14-18(3)4)30-27(34)36-16-20-11-9-8-10-12-20/h8-12,17-19,21-23H,13-16H2,1-7H3,(H,28,32)(H,29,31)(H,30,34)
InChIKey IUFKCGIZJPZEMT-UHFFFAOYSA-N
Mol Weight 505.7 g/mol
Molecular Formula C27H43N3O6
Exact Mass 505.315186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mtwjdIiAUA
Name Methyl 5,8,11-triisobutyl-3,6,9-trioxo-1-phenyl-2-oxa-4,7,10-triazadodecan-12-oate
CAS Registry Number 66013-79-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H43N3O6
InChI InChI=1S/C27H43N3O6/c1-17(2)13-21(24(31)29-23(15-19(5)6)26(33)35-7)28-25(32)22(14-18(3)4)30-27(34)36-16-20-11-9-8-10-12-20/h8-12,17-19,21-23H,13-16H2,1-7H3,(H,28,32)(H,29,31)(H,30,34)
InChIKey IUFKCGIZJPZEMT-UHFFFAOYSA-N
Molecular Weight 505.656 g/mol
SMILES N(C(OCc1ccccc1)=O)C(C(=O)NC(C(=O)NC(CC(C)C)C(=O)OC)CC(C)C)CC(C)C
SPLASH splash10-000f-9210000000-89c952ce091446135dfd
Synonyms 2-[[2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-valeric acid methyl ester 4-Methyl-2-[[4-methyl-2-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-1-oxopentyl]amino]pentanoic acid methyl ester l-Leucine, N-[N-[N-[(phenylmethoxy)carbonyl]-l-leucyl]-l-leucyl]-, methyl ester Methyl 2-[[2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoate Methyl 4-methyl-2-[[4-methyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]pentanoate
Wiley ID 1485446