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5-(Phenylcarbonyl)-6-(trifluoromethyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
SpectraBase Compound ID JUnzvTzDWTT
InChI InChI=1S/C16H12F3NO3/c17-16(18,19)11-8-12-10(15(22)23)6-7-20(12)13(11)14(21)9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H,22,23)
InChIKey JLXHFJCUDWMYFK-UHFFFAOYSA-N
Mol Weight 323.27 g/mol
Molecular Formula C16H12F3NO3
Exact Mass 323.076928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oDEu8PlEe
Name 5-(Phenylcarbonyl)-6-(trifluoromethyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12F3NO3
InChI InChI=1S/C16H12F3NO3/c17-16(18,19)11-8-12-10(15(22)23)6-7-20(12)13(11)14(21)9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H,22,23)
InChIKey JLXHFJCUDWMYFK-UHFFFAOYSA-N
Molecular Weight 323.271 g/mol
SMILES OC(C1c2[n](CC1)c(c(c2)C(F)(F)F)C(c1ccccc1)=O)=O
SPLASH splash10-004i-8693000000-57b7f18f1cdf5e9f2dac
Source of Spectrum O1-63-2076-1
Synonyms 5-Benzoyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
Wiley ID 1592789