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Penfluridol
SpectraBase Compound ID Kb0MwpjxOe4
InChI InChI=1S/C28H27ClF5NO/c29-26-12-7-21(18-25(26)28(32,33)34)27(36)13-16-35(17-14-27)15-1-2-24(19-3-8-22(30)9-4-19)20-5-10-23(31)11-6-20/h3-12,18,24,36H,1-2,13-17H2
InChIKey MDLAAYDRRZXJIF-UHFFFAOYSA-N
Mol Weight 523.98 g/mol
Molecular Formula C28H27ClF5NO
Exact Mass 523.170133 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2V5WiPRnG9H
Name PENFLURIDOL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H27ClF5NO
InChI InChI=1S/C28H27ClF5NO/c29-26-12-7-21(18-25(26)28(32,33)34)27(36)13-16-35(17-14-27)15-1-2-24(19-3-8-22(30)9-4-19)20-5-10-23(31)11-6-20/h3-12,18,24,36H,1-2,13-17H2
InChIKey MDLAAYDRRZXJIF-UHFFFAOYSA-N
Instrument Name DI
Molecular Weight 523.975 g/mol
SMILES OC1(c2cc(C(F)(F)F)c(Cl)cc2)CCN(CC1)CCCC(c1ccc(F)cc1)c1ccc(F)cc1
SPLASH splash10-0a4l-5590000000-8507f35edef140b7c4e4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany