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1-Butanone, 1-(4-fluorophenyl)-4-[4-(3-fiuoropropoxy)-1-phenyl-1,3,8-triazaspiro[4,5]dec-3-en-8-yl]-
SpectraBase Compound ID EEQDx10Vwdj
InChI InChI=1S/C26H31F2N3O2/c27-15-5-19-33-25-26(31(20-29-25)23-6-2-1-3-7-23)13-17-30(18-14-26)16-4-8-24(32)21-9-11-22(28)12-10-21/h1-3,6-7,9-12H,4-5,8,13-20H2
InChIKey OTNGKBQKBNOYLH-UHFFFAOYSA-N
Mol Weight 455.55 g/mol
Molecular Formula C26H31F2N3O2
Exact Mass 455.238434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lni6dciZo0
Name 1-Butanone, 1-(4-fluorophenyl)-4-[4-(3-fiuoropropoxy)-1-phenyl-1,3,8-triazaspiro[4,5]dec-3-en-8-yl]-
Alternate Name(s) 1-(4-fluorophenyl)-4-[4-(3-fluoropropoxy)-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-en-8-yl]-1-butanone
CAS Registry Number 106114-45-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31F2N3O2
InChI InChI=1S/C26H31F2N3O2/c27-15-5-19-33-25-26(31(20-29-25)23-6-2-1-3-7-23)13-17-30(18-14-26)16-4-8-24(32)21-9-11-22(28)12-10-21/h1-3,6-7,9-12H,4-5,8,13-20H2
InChIKey OTNGKBQKBNOYLH-UHFFFAOYSA-N
Molecular Weight 455.550 g/mol
SMILES C12(N(CN=C2OCCCF)c2ccccc2)CCN(CC1)CCCC(c1ccc(cc1)F)=O
SPLASH splash10-0g4i-0935100000-3016350c463b74160f2b
Source of Spectrum J-52-663-9
Wiley ID 1389059