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PCPR-M (3'-HO-) isomer-1 AC
SpectraBase Compound ID IZONH2BXDtB
InChI InChI=1S/C17H25NO2/c1-3-12-18-17(15-8-5-4-6-9-15)11-7-10-16(13-17)20-14(2)19/h4-6,8-9,16,18H,3,7,10-13H2,1-2H3
InChIKey QALSPXQIBASLGY-UHFFFAOYSA-N
Mol Weight 275.39 g/mol
Molecular Formula C17H25NO2
Exact Mass 275.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54z52rMa9Y
Name PCPR-M (3'-HO-) isomer-1 AC
Classification Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 275.188529047 u
Formula C17H25NO2
InChI InChI=1S/C17H25NO2/c1-3-12-18-17(15-8-5-4-6-9-15)11-7-10-16(13-17)20-14(2)19/h4-6,8-9,16,18H,3,7,10-13H2,1-2H3
InChIKey QALSPXQIBASLGY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 275.392 g/mol
SMILES c1(C2(CC(CCC2)OC(C)=O)NCCC)ccccc1
SPLASH splash10-014i-1980000000-7d355317db2d9ac01c6c
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.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms 1-(1-Phenylcyclohexyl)-propanamine-M (3'-HO-) isomer-1 AC
Technique GC/MS
Wiley ID MMPW6e_7392