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7-[(3'-Chloroisoxazol-5'-yl)acetylamino]-3-methyl-2-iso-oxacephem-4-carboxylic acid
SpectraBase Compound ID GYLB8mdYWt7
InChI InChI=1S/C13H12ClN3O6/c1-5-11(13(20)21)17-7(4-22-5)10(12(17)19)15-9(18)3-6-2-8(14)16-23-6/h2,7,10H,3-4H2,1H3,(H,15,18)(H,20,21)
InChIKey FJFBSEZPPWYCFU-UHFFFAOYSA-N
Mol Weight 341.71 g/mol
Molecular Formula C13H12ClN3O6
Exact Mass 341.041463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNfnPEheAgy
Name 7-[(3'-Chloroisoxazol-5'-yl)acetylamino]-3-methyl-2-iso-oxacephem-4-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClN3O6
InChI InChI=1S/C13H12ClN3O6/c1-5-11(13(20)21)17-7(4-22-5)10(12(17)19)15-9(18)3-6-2-8(14)16-23-6/h2,7,10H,3-4H2,1H3,(H,15,18)(H,20,21)
InChIKey FJFBSEZPPWYCFU-UHFFFAOYSA-N
Molecular Weight 341.707 g/mol
SMILES OC(C=1N2C(C(C2=O)NC(Cc2cc(Cl)no2)=O)COC1C)=O
SPLASH splash10-0295-9810000000-bc9c7bf4f7fcc1b17382
Source of Spectrum U-1995-831-2
Synonyms 7-[[2-(3-chloro-5-isoxazolyl)-1-oxoethyl]amino]-3-methyl-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 7-[[2-(3-chloro-1,2-oxazol-5-yl)acetyl]amino]-3-methyl-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 7-[[2-(3-chloroisoxazol-5-yl)acetyl]amino]-3-methyl-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 7-[2-(3-chloranyl-1,2-oxazol-5-yl)ethanoylamino]-3-methyl-8-oxidanylidene-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Wiley ID 766707