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l-Isoleucine, N-isobutoxycarbonyl-, dodecyl ester
SpectraBase Compound ID FPpndC90t5d
InChI InChI=1S/C23H45NO4/c1-6-8-9-10-11-12-13-14-15-16-17-27-22(25)21(20(5)7-2)24-23(26)28-18-19(3)4/h19-21H,6-18H2,1-5H3,(H,24,26)
InChIKey QPCDXRDWAYSTJS-UHFFFAOYSA-N
Mol Weight 399.6 g/mol
Molecular Formula C23H45NO4
Exact Mass 399.334859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kj6WgzQX4kV
Name l-Isoleucine, N-isobutoxycarbonyl-, dodecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H45NO4
InChI InChI=1S/C23H45NO4/c1-6-8-9-10-11-12-13-14-15-16-17-27-22(25)21(20(5)7-2)24-23(26)28-18-19(3)4/h19-21H,6-18H2,1-5H3,(H,24,26)
InChIKey QPCDXRDWAYSTJS-UHFFFAOYSA-N
Molecular Weight 399.616 g/mol
SMILES N(C(OCC(C)C)=O)C(C(CC)C)C(OCCCCCCCCCCCC)=O
SPLASH splash10-000i-5900000000-2bf259a437ac59e37560
Source of Spectrum NP-14-4535-0
Synonyms 3-Methyl-2-[[2-methylpropoxy(oxo)methyl]amino]pentanoic acid dodecyl ester Dodecyl 2-(isobutoxycarbonylamino)-3-methyl-pentanoate Dodecyl 3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate
Wiley ID 1111777