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Benzyl (.alpha.-R)-3-(1'-acetoxyethyl)-3-methyl-2-isoxacephem-4-carboxylate
SpectraBase Compound ID KP7ZxdQoCZb
InChI InChI=1S/C19H21NO6/c1-11(26-13(3)21)16-15-10-24-12(2)17(20(15)18(16)22)19(23)25-9-14-7-5-4-6-8-14/h4-8,11,15-16H,9-10H2,1-3H3/t11-,15+,16+/m1/s1
InChIKey JZBSAZKHASUHDT-RLCCDNCMSA-N
Mol Weight 359.38 g/mol
Molecular Formula C19H21NO6
Exact Mass 359.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZiGdOFBOPY
Name Benzyl (.alpha.-R)-3-(1'-acetoxyethyl)-3-methyl-2-isoxacephem-4-carboxylate
Alternate Name(s) Benzyl 7-(1'-acetoxyethyl)-3-methyl-2-isoxacephem-4-carboxylate (6R,7R)-7-[(1R)-1-acetyloxyethyl]-3-methyl-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (phenylmethyl) ester benzyl (6R,7R)-7-[(1R)-1-acetyloxyethyl]-3-methyl-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate benzyl (6R,7R)-7-[(1R)-1-acetoxyethyl]-3-methyl-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (phenylmethyl) (6R,7R)-7-[(1R)-1-acetyloxyethyl]-3-methyl-8-oxidanylidene-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
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Formula C19H21NO6
InChI InChI=1S/C19H21NO6/c1-11(26-13(3)21)16-15-10-24-12(2)17(20(15)18(16)22)19(23)25-9-14-7-5-4-6-8-14/h4-8,11,15-16H,9-10H2,1-3H3/t11-,15+,16+/m1/s1
InChIKey JZBSAZKHASUHDT-RLCCDNCMSA-N
Molecular Weight 359.378 g/mol
SMILES C1(N2[C@]([C@@]1([C@](OC(=O)C)(C)[H])[H])(COC(=C2C(OCc1ccccc1)=O)C)[H])=O
SPLASH splash10-0006-9012000000-4f451f480cc7955a68bc
Source of Spectrum AH-135-680-16
Wiley ID 1576576