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t-Butyl 7-[(3'-chloroisoxazol-5'-yl)acetylamino]-3-methyl-2-iso-oxacephem-4-carboxylate
SpectraBase Compound ID 4R2uVS4geqd
InChI InChI=1S/C17H20ClN3O6/c1-8-14(16(24)26-17(2,3)4)21-10(7-25-8)13(15(21)23)19-12(22)6-9-5-11(18)20-27-9/h5,10,13H,6-7H2,1-4H3,(H,19,22)
InChIKey JDRMZGZATLRHRC-UHFFFAOYSA-N
Mol Weight 397.82 g/mol
Molecular Formula C17H20ClN3O6
Exact Mass 397.104063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2MkwKarVnE
Name t-Butyl 7-[(3'-chloroisoxazol-5'-yl)acetylamino]-3-methyl-2-iso-oxacephem-4-carboxylate
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Formula C17H20ClN3O6
InChI InChI=1S/C17H20ClN3O6/c1-8-14(16(24)26-17(2,3)4)21-10(7-25-8)13(15(21)23)19-12(22)6-9-5-11(18)20-27-9/h5,10,13H,6-7H2,1-4H3,(H,19,22)
InChIKey JDRMZGZATLRHRC-UHFFFAOYSA-N
Molecular Weight 397.815 g/mol
SMILES N(C1C2N(C1=O)C(C(OC(C)(C)C)=O)=C(C)OC2)C(Cc1cc(Cl)no1)=O
SPLASH splash10-0abc-5900000000-5492119d6c5243beef40
Source of Spectrum U-1995-831-22
Wiley ID 766708