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(4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(phenylmethylsulfanyl)pentanoic acid
SpectraBase Compound ID FQAVdnpDMcx
InChI InChI=1S/C17H25NO4S/c1-17(2,3)22-16(21)18-14(9-10-15(19)20)12-23-11-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3,(H,18,21)(H,19,20)/t14-/m1/s1
InChIKey IMGMSORHFKWMIV-CQSZACIVSA-N
Mol Weight 339.45 g/mol
Molecular Formula C17H25NO4S
Exact Mass 339.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AhxXNZlZCBq
Name (4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(phenylmethylsulfanyl)pentanoic acid
Alternate Name(s) (4R)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-(phenylmethylthio)pentanoic acid (4R)-5-(benzylthio)-4-(tert-butoxycarbonylamino)valeric acid (4R)-5-benzylsulfanyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
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Formula C17H25NO4S
InChI InChI=1S/C17H25NO4S/c1-17(2,3)22-16(21)18-14(9-10-15(19)20)12-23-11-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3,(H,18,21)(H,19,20)/t14-/m1/s1
InChIKey IMGMSORHFKWMIV-CQSZACIVSA-N
Molecular Weight 339.450 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](CCC(=O)O)(CSCc1ccccc1)[H]
SPLASH splash10-0f6x-7930000000-d493fab0070415483f4d
Source of Spectrum F-53-12873-4
Wiley ID 803803