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Cbz-Aib-trans-Oxa(5-Me)-OMe
SpectraBase Compound ID LpT2jxEv7sV
InChI InChI=1S/C17H22N2O5/c1-11-13(14(20)22-4)18-15(24-11)17(2,3)19-16(21)23-10-12-8-6-5-7-9-12/h5-9,11,13H,10H2,1-4H3,(H,19,21)/t11-,13+/m1/s1
InChIKey BNQHZKGZFNAKNK-YPMHNXCESA-N
Mol Weight 334.37 g/mol
Molecular Formula C17H22N2O5
Exact Mass 334.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtBc1IkzD1u
Name Cbz-Aib-trans-Oxa(5-Me)-OMe
Alternate Name(s) Methyl (4S,5R)-2-(1-{[(benzyloxy)carbonyl]amino}-1-methylethyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxylate
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Formula C17H22N2O5
InChI InChI=1S/C17H22N2O5/c1-11-13(14(20)22-4)18-15(24-11)17(2,3)19-16(21)23-10-12-8-6-5-7-9-12/h5-9,11,13H,10H2,1-4H3,(H,19,21)/t11-,13+/m1/s1
InChIKey BNQHZKGZFNAKNK-YPMHNXCESA-N
Molecular Weight 334.372 g/mol
SMILES N(C(=O)OCc1ccccc1)C(C1=N[C@@]([C@](C)([H])O1)(C(=O)OC)[H])(C)C
SPLASH splash10-0016-9701000000-ee7d9ddfd8592b0438a3
Source of Spectrum AT-33-6270-10
Wiley ID 836363