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5-fluoro AB-7-PAICA
SpectraBase Compound ID 8dCrzWsv0X3
InChI InChI=1S/C18H25FN4O2/c1-12(2)15(16(20)24)22-18(25)14-11-23(10-5-3-4-8-19)17-13(14)7-6-9-21-17/h6-7,9,11-12,15H,3-5,8,10H2,1-2H3,(H2,20,24)(H,22,25)/t15-/m0/s1
InChIKey PEAJNPAIVYHNDQ-HNNXBMFYSA-N
Mol Weight 348.42 g/mol
Molecular Formula C18H25FN4O2
Exact Mass 348.196154 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID I2kGWB5ie6X
Name 5-Fluoro AB-7-PAICA
Source of Sample Cayman Chemical Company
Catalog Number 26646
Lot Number 0588638-9
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
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Formula C18H25FN4O2
IUPAC Name (S)-N-(1-Amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
InChI InChI=1S/C18H25FN4O2/c1-12(2)15(16(20)24)22-18(25)14-11-23(10-5-3-4-8-19)17-13(14)7-6-9-21-17/h6-7,9,11-12,15H,3-5,8,10H2,1-2H3,(H2,20,24)(H,22,25)/t15-/m0/s1
InChIKey PEAJNPAIVYHNDQ-HNNXBMFYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 348.422 g/mol
Purity >=98%
SMILES N(C(=O)c1c[n](CCCCCF)c2c1cccn2)[C@](C(N)=O)(C(C)C)[H]
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms 5-Fluoro AB-P7AICA​
Technique ATR-Neat
UV - Neutral Conditions UVmax (nm): 215, 244, 293