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1-(3-Methylphenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol, tms

View entire compound with spectra: 1 NMR

1-(3-Methylphenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol, tms
SpectraBase Compound ID LWdQjmOjftR
InChI InChI=1S/C23H34N2O2Si/c1-20-9-8-12-22(17-20)26-19-23(27-28(2,3)4)18-24-13-15-25(16-14-24)21-10-6-5-7-11-21/h5-12,17,23H,13-16,18-19H2,1-4H3
InChIKey BVKWDZJMRDEREQ-UHFFFAOYSA-N
Mol Weight 398.6 g/mol
Molecular Formula C23H34N2O2Si
Exact Mass 398.238955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CdpkPaClyli
Name 1-(3-Methylphenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol, tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.238954876 u
Formula C23H34N2O2Si
InChI InChI=1S/C23H34N2O2Si/c1-20-9-8-12-22(17-20)26-19-23(27-28(2,3)4)18-24-13-15-25(16-14-24)21-10-6-5-7-11-21/h5-12,17,23H,13-16,18-19H2,1-4H3
InChIKey BVKWDZJMRDEREQ-UHFFFAOYSA-N
Molecular Weight 398.622 g/mol
SMILES C(C(COC1=CC(C)=CC=C1)O[Si](C)(C)C)N1CCN(CC1)C1=CC=CC=C1