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6-Acetyl-7-oxo-6-azabicyclo[3.2.0]hept-2-en-2-carboxylic acid
SpectraBase Compound ID Lesb43NYOAH
InChI InChI=1S/C9H9NO4/c1-4(11)10-6-3-2-5(9(13)14)7(6)8(10)12/h2,6-7H,3H2,1H3,(H,13,14)
InChIKey FAUUJGTWDMOPRS-UHFFFAOYSA-N
Mol Weight 195.17 g/mol
Molecular Formula C9H9NO4
Exact Mass 195.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H5Hb5x0Rd03
Name 6-Acetyl-7-oxo-6-azabicyclo[3.2.0]hept-2-en-2-carboxylic acid
Alternate Name(s) (1S*,5R*)-6-Acetyl-7-oxo-6-azabicyclo[3.2.0]hept-2-en-2-carboxylic acid 6-Acetyl-7-oxo-6-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO4
InChI InChI=1S/C9H9NO4/c1-4(11)10-6-3-2-5(9(13)14)7(6)8(10)12/h2,6-7H,3H2,1H3,(H,13,14)
InChIKey FAUUJGTWDMOPRS-UHFFFAOYSA-N
Molecular Weight 195.174 g/mol
SMILES OC(C=1C2C(N(C2=O)C(=O)C)CC1)=O
SPLASH splash10-0002-0900000000-0b8c443ed12027663b14
Source of Spectrum F-50-12061-16
Wiley ID 789888