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5-Fluoro-PB-22 3-carboxyindole metabolite-d5
SpectraBase Compound ID CWSZcEiisEG
InChI InChI=1S/C14H16FNO2/c15-8-4-1-5-9-16-10-12(14(17)18)11-6-2-3-7-13(11)16/h2-3,6-7,10H,1,4-5,8-9H2,(H,17,18)/i2D,3D,6D,7D,10D
InChIKey DYLIZXRQZRUDLA-ZYNMDDLASA-N
Mol Weight 254.32 g/mol
Molecular Formula C14H112D5FNO2
Exact Mass 254.147891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nKhc0rvXFh
Name 5-Fluoro-PB-22 3-carboxyindole metabolite-d5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11D5FNO2
InChI InChI=1S/C14H16FNO2/c15-8-4-1-5-9-16-10-12(14(17)18)11-6-2-3-7-13(11)16/h2-3,6-7,10H,1,4-5,8-9H2,(H,17,18)/i2D,3D,6D,7D,10D
InChIKey DYLIZXRQZRUDLA-ZYNMDDLASA-N
Molecular Weight 254.316 g/mol
SMILES OC(c1c([n](c2c1c(c(c(c2[2D])[2D])[2D])[2D])CCCCCF)[2D])=O
SPLASH splash10-004i-2930000000-9ca999ac74f50fce1a8d
Source of Spectrum SWG-33-4644-0
Synonyms 5F-PB-22 3-carboxyindole metabolite-d5 1-(5-fluoropentyl)-1H-indole-3-carboxylic-2,4,5,6,7-d5 acid
Wiley ID 1811240