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2C-P-M isomer-1 2AC
SpectraBase Compound ID 1wpAQNivrTv
InChI InChI=1S/C16H22O5/c1-5-6-13-10-16(21-12(3)18)14(9-15(13)19-4)7-8-20-11(2)17/h9-10H,5-8H2,1-4H3
InChIKey KRORGQCRMVZYEU-UHFFFAOYSA-N
Mol Weight 294.35 g/mol
Molecular Formula C16H22O5
Exact Mass 294.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3RVQ54Pusq
Name 2C-P-M (O-demethyl-deamino-HO) 2AC
Classification Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 294.146723803 u
Formula C16H22O5
InChI InChI=1S/C16H22O5/c1-5-6-13-10-16(21-12(3)18)14(9-15(13)19-4)7-8-20-11(2)17/h9-10H,5-8H2,1-4H3
InChIKey KRORGQCRMVZYEU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 294.347 g/mol
SMILES C(OC(C)=O)Cc1c(cc(c(OC)c1)CCC)OC(C)=O
SPLASH splash10-0006-1920000000-612641c8491d7358d043
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: UGLUCSPEAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms 2C-P-M (O-demethyl-deamino-HO-) AC
Technique GC/MS
Wiley ID MMPW6e_8936