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Trazodone-M isomer-1 2TFA     @
SpectraBase Compound ID 9s8WNLTY6n6
InChI InChI=1S/C14H11ClF6N2O3/c15-9-7-8(1-2-10(9)26-12(25)14(19,20)21)22-3-5-23(6-4-22)11(24)13(16,17)18/h1-2,7H,3-6H2
InChIKey JAXSFYOUPBETQO-UHFFFAOYSA-N
Mol Weight 404.7 g/mol
Molecular Formula C14H11ClF6N2O3
Exact Mass 404.036239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPqpN1HWc0a
Name Trazodone-M isomer-2 2TFA @
Classification Antidepressant Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 404.036238897 u
Formula C14H11F6ClN2O3
InChI InChI=1S/C14H11ClF6N2O3/c15-9-7-8(1-2-10(9)26-12(25)14(19,20)21)22-3-5-23(6-4-22)11(24)13(16,17)18/h1-2,7H,3-6H2
InChIKey JAXSFYOUPBETQO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 404.696 g/mol
SMILES c1cc(N2CCN(C(C(F)(F)F)=O)CC2)cc(Cl)c1OC(C(F)(F)F)=O
SPLASH splash10-0pvi-9522100000-96ae90d1862405e26d7b
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+UHYTFA
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms m-Chlorophenylpiperazine-M (HO-) isomer-2 2TFA m-Chlorophenylpiperazine-M (HO-) isomer-2 2TFA mCPP-M (HO-) isomer-2 2TFA Nefazodone-M (N-dealkyl-HO-) isomer-2 2TFA Trazodone-M (N-dealkyl-HO-) isomer-2 2TFA
Technique GC/MS
Wiley ID MMPW6e_6598