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6-[1-Hydroxyethyl]-3-methoxy-7-oxo-1-azabicyclo[3.2.0]hept-2-en-2-carboxylic acid
SpectraBase Compound ID E6TtGo407R1
InChI InChI=1S/C10H13NO5/c1-4(12)7-5-3-6(16-2)8(10(14)15)11(5)9(7)13/h4-5,7,12H,3H2,1-2H3,(H,14,15)
InChIKey JQVSNQBXQNNKIW-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C10H13NO5
Exact Mass 227.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2iw6bjWQORG
Name 6-[1-Hydroxyethyl]-3-methoxy-7-oxo-1-azabicyclo[3.2.0]hept-2-en-2-carboxylic acid
Alternate Name(s) 6-(1-hydroxyethyl)-3-methoxy-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 6.alpha.-[1-(R)-Hydroxyethyl]-3-methoxy-7-oxo-1-azabicyclo[3.2.0]hept-2-en-2-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C10H13NO5
InChI InChI=1S/C10H13NO5/c1-4(12)7-5-3-6(16-2)8(10(14)15)11(5)9(7)13/h4-5,7,12H,3H2,1-2H3,(H,14,15)
InChIKey JQVSNQBXQNNKIW-UHFFFAOYSA-N
Molecular Weight 227.216 g/mol
SMILES OC(C1C(N2C(C(=O)O)=C(CC12)OC)=O)C
SPLASH splash10-03di-0900000000-a0d585e28abfffe0d586
Source of Spectrum QB-10-34-4
Wiley ID 840933