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cis-8(R)-[(tert-Butoxycarbonyl)amino]-9-mercaptonon-6-enoic Acid
SpectraBase Compound ID JtvYjOWaae3
InChI InChI=1S/C14H25NO4S/c1-14(2,3)19-13(18)15-11(10-20)8-6-4-5-7-9-12(16)17/h6,8,11,20H,4-5,7,9-10H2,1-3H3,(H,15,18)(H,16,17)/b8-6-/t11-/m1/s1
InChIKey OHYOLLMFFHJDKP-BPOWMSRESA-N
Mol Weight 303.42 g/mol
Molecular Formula C14H25NO4S
Exact Mass 303.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUnMU49xseA
Name cis-8(R)-[(tert-Butoxycarbonyl)amino]-9-mercaptonon-6-enoic Acid
Alternate Name(s) (6Z,8R)-8-[(tert-butoxycarbonyl)amino]-9-sulfanyl-6-nonenoic acid (Z,8R)-9-mercapto-8-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-nonenoic acid (Z,8R)-8-[(2-methylpropan-2-yl)oxycarbonylamino]-9-sulfanylnon-6-enoic acid (Z,8R)-8-(tert-butoxycarbonylamino)-9-sulfanyl-non-6-enoic acid (Z,8R)-8-[(2-methylpropan-2-yl)oxycarbonylamino]-9-sulfanyl-non-6-enoic acid
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Formula C14H25NO4S
InChI InChI=1S/C14H25NO4S/c1-14(2,3)19-13(18)15-11(10-20)8-6-4-5-7-9-12(16)17/h6,8,11,20H,4-5,7,9-10H2,1-3H3,(H,15,18)(H,16,17)/b8-6-/t11-/m1/s1
InChIKey OHYOLLMFFHJDKP-BPOWMSRESA-N
Molecular Weight 303.417 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](CS)(\C=C/CCCCC(=O)O)[H]
SPLASH splash10-0a4i-9100000000-2b9372f840c852264b12
Source of Spectrum J-60-328-10
Wiley ID 1305479