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Benzyl 2-(S)-((tert-Butoxycarbonyl)amino)-5-(4'-methoxyphenyl)pentanoate
SpectraBase Compound ID APpRY30wudA
InChI InChI=1S/C24H31NO5/c1-24(2,3)30-23(27)25-21(22(26)29-17-19-9-6-5-7-10-19)12-8-11-18-13-15-20(28-4)16-14-18/h5-7,9-10,13-16,21H,8,11-12,17H2,1-4H3,(H,25,27)/t21-/m0/s1
InChIKey WUQVRRAIKNMGOQ-NRFANRHFSA-N
Mol Weight 413.51 g/mol
Molecular Formula C24H31NO5
Exact Mass 413.220223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sU1u5SAhMJ
Name Benzyl 2-(S)-((tert-Butoxycarbonyl)amino)-5-(4'-methoxyphenyl)pentanoate
Alternate Name(s) benzyl (2S)-2-[(tert-butoxycarbonyl)amino]-5-(4-methoxyphenyl)pentanoate
Comments Less than 3 mono-isotopic peaks
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Formula C24H31NO5
InChI InChI=1S/C24H31NO5/c1-24(2,3)30-23(27)25-21(22(26)29-17-19-9-6-5-7-10-19)12-8-11-18-13-15-20(28-4)16-14-18/h5-7,9-10,13-16,21H,8,11-12,17H2,1-4H3,(H,25,27)/t21-/m0/s1
InChIKey WUQVRRAIKNMGOQ-NRFANRHFSA-N
Molecular Weight 413.514 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(OCc1ccccc1)=O)(CCCc1ccc(cc1)OC)[H]
SPLASH splash10-0a4i-0009000000-a54927dde0bb3b6384b8
Source of Spectrum J-63-7883-8
Wiley ID 1375050