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10H-Phenothiazine, 10-[3-(4-methyl-1-piperazinyl-2,2,6,6-D4)propyl]-2-(trifluoromethyl)-
SpectraBase Compound ID KngRRO9SYn9
InChI InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3/i13D2,14D2
InChIKey ZEWQUBUPAILYHI-RYIWKTDQSA-N
Mol Weight 411.52 g/mol
Molecular Formula C21H202D4F3N3S
Exact Mass 411.18941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17Cnj0xAS88
Name 10H-Phenothiazine, 10-[3-(4-methyl-1-piperazinyl-2,2,6,6-D4)propyl]-2-(trifluoromethyl)-
Alternate Name(s) Trifluoperazine D4 10-[3-(2,2,6,6-tetradeuterio-4-methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)phenothiazine 10-[3-(2,2,6,6-tetradeuterio-4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine 10-[3-(2,2,6,6-tetradeuterio-4-methyl-piperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine
CAS Registry Number 81605-97-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20D4F3N3S
InChI InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3/i13D2,14D2
InChIKey ZEWQUBUPAILYHI-RYIWKTDQSA-N
Molecular Weight 411.524 g/mol
SMILES c12N(c3c(Sc2ccc(C(F)(F)F)c1)cccc3)CCCN1C(CN(CC1([2D])[2D])C)([2D])[2D]
SPLASH splash10-01b9-4920200000-15581f97f1e500b65522
Source of Spectrum KO-9-188-1
Wiley ID 121449