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6-Acetyl-3,6,7,8-tetrahydrobenzo[1,2-b:4,3-b]dipyrrole-2-carboxylic acid
SpectraBase Compound ID HK0yzAFjwPM
InChI InChI=1S/C13H12N2O3/c1-7(16)15-5-4-8-9-6-11(13(17)18)14-10(9)2-3-12(8)15/h2-3,6,14H,4-5H2,1H3,(H,17,18)
InChIKey JXWODXRCJIENIA-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C13H12N2O3
Exact Mass 244.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kEMCbK9QDU
Name 6-Acetyl-3,6,7,8-tetrahydrobenzo[1,2-b:4,3-b]dipyrrole-2-carboxylic acid
CAS Registry Number 105518-48-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O3
InChI InChI=1S/C13H12N2O3/c1-7(16)15-5-4-8-9-6-11(13(17)18)14-10(9)2-3-12(8)15/h2-3,6,14H,4-5H2,1H3,(H,17,18)
InChIKey JXWODXRCJIENIA-UHFFFAOYSA-N
Molecular Weight 244.250 g/mol
SMILES OC(c1cc2c3CCN(c3ccc2[nH]1)C(=O)C)=O
SPLASH splash10-053r-0930000000-abf35cfc4cc7b52e7fd2
Source of Spectrum J-52-25-5
Synonyms 6-Acetyl-3,6,7,8-tetrahydropyrrolo[3,2-e]indole-2-carboxylic acid
Wiley ID 1246883