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4-(4'-Hydroxyphenyl)-2S-[(t-butoxycarbonyl)amino]-butanoic acid - Benzyl ester
SpectraBase Compound ID AKm6BxCPWiJ
InChI InChI=1S/C22H27NO5/c1-22(2,3)28-21(26)23-19(14-11-16-9-12-18(24)13-10-16)20(25)27-15-17-7-5-4-6-8-17/h4-10,12-13,19,24H,11,14-15H2,1-3H3,(H,23,26)/t19-/m0/s1
InChIKey TUGATYPJMVKFAH-IBGZPJMESA-N
Mol Weight 385.46 g/mol
Molecular Formula C22H27NO5
Exact Mass 385.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EnHhOvj72MZ
Name 4-(4'-Hydroxyphenyl)-2S-[(t-butoxycarbonyl)amino]-butanoic acid - Benzyl ester
Alternate Name(s) (S)-benzyl 2-((tert-butoxycarbonyl)amino)-4-(4-hydroxyphenyl)butanoate (2S)-4-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid (phenylmethyl) ester Benzyl (2S)-4-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Benzyl (2S)-2-(tert-butoxycarbonylamino)-4-(4-hydroxyphenyl)butanoate (phenylmethyl) (2S)-4-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
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Formula C22H27NO5
InChI InChI=1S/C22H27NO5/c1-22(2,3)28-21(26)23-19(14-11-16-9-12-18(24)13-10-16)20(25)27-15-17-7-5-4-6-8-17/h4-10,12-13,19,24H,11,14-15H2,1-3H3,(H,23,26)/t19-/m0/s1
InChIKey TUGATYPJMVKFAH-IBGZPJMESA-N
Molecular Weight 385.460 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](CCc1ccc(cc1)O)(C(OCc1ccccc1)=O)[H]
SPLASH splash10-004i-0922000000-dd2e49581d22eb004db8
Source of Spectrum F5-2-113-10
Wiley ID 1731642