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Paliperidone
SpectraBase Compound ID B3Iq5F1JsCn
InChI InChI=1S/C23H27FN4O3/c1-14-17(23(30)28-9-2-3-19(29)22(28)25-14)8-12-27-10-6-15(7-11-27)21-18-5-4-16(24)13-20(18)31-26-21/h4-5,13,15,19,29H,2-3,6-12H2,1H3
InChIKey PMXMIIMHBWHSKN-UHFFFAOYSA-N
Mol Weight 426.49 g/mol
Molecular Formula C23H27FN4O3
Exact Mass 426.206719 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6DMgvnNqHIs
Name Paliperidone
Source of Sample Cayman Chemical Company
Catalog Number 15556
Lot Number 0455871-19
Apodization Function Norton-Beer, medium
CAS Registry Number 144598-75-4
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27FN4O3
IUPAC Name 3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
InChI InChI=1S/C23H27FN4O3/c1-14-17(23(30)28-9-2-3-19(29)22(28)25-14)8-12-27-10-6-15(7-11-27)21-18-5-4-16(24)13-20(18)31-26-21/h4-5,13,15,19,29H,2-3,6-12H2,1H3
InChIKey PMXMIIMHBWHSKN-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 426.492 g/mol
SMILES OC1\C=2N(CCC1)C(\C(=C/(N\2)C)CCN1CCC(CC1)c1noc2c1ccc(c2)F)=O
Source of Spectrum Forensic Spectral Research
Synonyms 9-Hydroxyrisperidone
Technique KBr0