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5-Benzoyl-6-trifluoromethyl-1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-1,7-dicarboxylic acid
SpectraBase Compound ID L35KTdgbhBo
InChI InChI=1S/C17H12F3NO5/c18-17(19,20)11-10(16(25)26)12-9(15(23)24)6-7-21(12)13(11)14(22)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,23,24)(H,25,26)
InChIKey PJJKJPGCWZHPQR-UHFFFAOYSA-N
Mol Weight 367.28 g/mol
Molecular Formula C17H12F3NO5
Exact Mass 367.066757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KaOzlD2P4mB
Name 5-Benzoyl-6-trifluoromethyl-1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-1,7-dicarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12F3NO5
InChI InChI=1S/C17H12F3NO5/c18-17(19,20)11-10(16(25)26)12-9(15(23)24)6-7-21(12)13(11)14(22)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,23,24)(H,25,26)
InChIKey PJJKJPGCWZHPQR-UHFFFAOYSA-N
Molecular Weight 367.280 g/mol
SMILES OC(C1CC[n]2c1c(C(=O)O)c(c2C(c1ccccc1)=O)C(F)(F)F)=O
SPLASH splash10-0kdi-7519000000-ffa99698626da89473fb
Source of Spectrum O1-63-2076-10
Synonyms 5-Benzoyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrrolo[1,2-a]pyrrole-1,7-dicarboxylic acid
Wiley ID 1592794