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(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid methyl ester
SpectraBase Compound ID LFFoIn1cgYy
InChI InChI=1S/C20H30N2O6/c1-20(2,3)28-19(25)22-16(17(23)26-4)12-8-9-13-21-18(24)27-14-15-10-6-5-7-11-15/h5-7,10-11,16H,8-9,12-14H2,1-4H3,(H,21,24)(H,22,25)/t16-/m0/s1
InChIKey PUJVYJATJHQXRX-INIZCTEOSA-N
Mol Weight 394.47 g/mol
Molecular Formula C20H30N2O6
Exact Mass 394.210387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3qwurofkYm
Name (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid methyl ester
Alternate Name(s) (2S)-6-(benzyloxycarbonylamino)-2-(tert-butoxycarbonylamino)hexanoic acid methyl ester Methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoate
CAS Registry Number 73548-77-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30N2O6
InChI InChI=1S/C20H30N2O6/c1-20(2,3)28-19(25)22-16(17(23)26-4)12-8-9-13-21-18(24)27-14-15-10-6-5-7-11-15/h5-7,10-11,16H,8-9,12-14H2,1-4H3,(H,21,24)(H,22,25)/t16-/m0/s1
InChIKey PUJVYJATJHQXRX-INIZCTEOSA-N
Molecular Weight 394.468 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](CCCCNC(=O)OCc1ccccc1)(C(=O)OC)[H]
SPLASH splash10-053r-9200000000-a4356d78d205f10407a3
Source of Spectrum F-38-710-0
Wiley ID 1366578