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Triflupromazine-M (HO-) AC
SpectraBase Compound ID 9Nqa92ryDlO
InChI InChI=1S/C20H21F3N2O2S/c1-13(26)27-15-6-8-19-17(12-15)25(10-4-9-24(2)3)16-11-14(20(21,22)23)5-7-18(16)28-19/h5-8,11-12H,4,9-10H2,1-3H3
InChIKey BBZHFPHPZXKKPQ-UHFFFAOYSA-N
Mol Weight 410.46 g/mol
Molecular Formula C20H21F3N2O2S
Exact Mass 410.127584 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lliil7n2Zpa
Name Triflupromazine-M (HO-) AC
Classification Neuroleptic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 410.127583585 u
Formula C20H21F3N2O2S
InChI InChI=1S/C20H21F3N2O2S/c1-13(26)27-15-6-8-19-17(12-15)25(10-4-9-24(2)3)16-11-14(20(21,22)23)5-7-18(16)28-19/h5-8,11-12H,4,9-10H2,1-3H3
InChIKey BBZHFPHPZXKKPQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 410.455 g/mol
SMILES c12Sc3c(N(c1cc(OC(C)=O)cc2)CCCN(C)C)cc(cc3)C(F)(F)F
SPLASH splash10-0a4i-9211000000-55c7987b71d31b2a71f4
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1299