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alpha-PPP-A (-4H)
SpectraBase Compound ID 3GHSDZIkDQL
InChI InChI=1S/C13H13NO/c1-11(14-9-5-6-10-14)13(15)12-7-3-2-4-8-12/h2-5,7-9H,1,6,10H2
InChIKey IPYGAFSEEKTXNG-UHFFFAOYSA-N
Mol Weight 199.25 g/mol
Molecular Formula C13H13NO
Exact Mass 199.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGZFzt7KLKa
Name alpha-PPP-A (-4H)
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 199.099714042 u
Formula C13H13NO
InChI InChI=1S/C13H13NO/c1-11(14-9-5-6-10-14)13(15)12-7-3-2-4-8-12/h2-5,7-9H,1,6,10H2
InChIKey IPYGAFSEEKTXNG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 199.253 g/mol
Nominal Mass 199 u
Quality 902
Retention Index 1559
SMILES C(C(C=1C=CC=CC1)=O)(N1C=CCC1)=C
SPLASH splash10-0006-9100000000-987802d6671b5f177e56
Sample Comments Double bond position uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(2,3-Dihydro-1H-pyrrol-1-yl)-1-phenylprop-2-en-1-one
Technique GC/MS
Wiley ID DD2024_023498