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(S)-O-Benzyl-N-(3-bromopropyl)-N-(tert-butoxycarbonyl)serine ethyl ester
SpectraBase Compound ID JAPzWra4IS9
InChI InChI=1S/C20H30BrNO5/c1-5-26-18(23)17(15-25-14-16-10-7-6-8-11-16)22(13-9-12-21)19(24)27-20(2,3)4/h6-8,10-11,17H,5,9,12-15H2,1-4H3/t17-/m0/s1
InChIKey FUCZZDJSBIGQFU-KRWDZBQOSA-N
Mol Weight 444.37 g/mol
Molecular Formula C20H30BrNO5
Exact Mass 443.130736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8DcbF9lojBy
Name (S)-O-Benzyl-N-(3-bromopropyl)-N-(tert-butoxycarbonyl)serine ethyl ester
Alternate Name(s) (S)-ethyl 3-(benzyloxy)-2-((3-bromopropyl)(tert-butoxycarbonyl)amino)propanoate
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Formula C20H30BrNO5
InChI InChI=1S/C20H30BrNO5/c1-5-26-18(23)17(15-25-14-16-10-7-6-8-11-16)22(13-9-12-21)19(24)27-20(2,3)4/h6-8,10-11,17H,5,9,12-15H2,1-4H3/t17-/m0/s1
InChIKey FUCZZDJSBIGQFU-KRWDZBQOSA-N
Literature Reference DOI 10.1021/ol801213c
Molecular Weight 444.366 g/mol
SMILES [C@@](N(C(=O)OC(C)(C)C)CCCBr)(COCc1ccccc1)(C(=O)OCC)[H]
SPLASH splash10-052f-9120000000-4ad0ad1e5988dcafcfa0
Source of Spectrum A1-10-3883/SM2-4
Wiley ID 1759670