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1,4-Dibenzyl-(S)-3-(4-fluoro-2-methylphenyl)-2-piperazinone
SpectraBase Compound ID 6mHQlRODnPz
InChI InChI=1S/C25H25FN2O/c1-19-16-22(26)12-13-23(19)24-25(29)28(18-21-10-6-3-7-11-21)15-14-27(24)17-20-8-4-2-5-9-20/h2-13,16,24H,14-15,17-18H2,1H3/t24-/m0/s1
InChIKey CYTCKPATXDRURT-DEOSSOPVSA-N
Mol Weight 388.49 g/mol
Molecular Formula C25H25FN2O
Exact Mass 388.195092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfDgYRf0dlj
Name 1,4-Dibenzyl-(S)-3-(4-fluoro-2-methylphenyl)-2-piperazinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25FN2O
InChI InChI=1S/C25H25FN2O/c1-19-16-22(26)12-13-23(19)24-25(29)28(18-21-10-6-3-7-11-21)15-14-27(24)17-20-8-4-2-5-9-20/h2-13,16,24H,14-15,17-18H2,1H3/t24-/m0/s1
InChIKey CYTCKPATXDRURT-DEOSSOPVSA-N
Molecular Weight 388.486 g/mol
SMILES [C@@]1(N(CCN(C1=O)Cc1ccccc1)Cc1ccccc1)(c1c(cc(cc1)F)C)[H]
SPLASH splash10-0005-5190000000-c740872e2f2827a6296d
Source of Spectrum F-67-6225-5e
Wiley ID 1687425