SpectraBase Spectrum ID |
JH3habi6L0y |
Name |
alpha-PiHP-A (-2H) |
Classification |
Designer drug artifact |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
243.162314299 u |
Formula |
C16H21NO |
InChI |
InChI=1S/C16H21NO/c1-13(2)12-15(17-10-6-7-11-17)16(18)14-8-4-3-5-9-14/h3-5,8-9,12-13H,6-7,10-11H2,1-2H3/b15-12- |
InChIKey |
MYFFWIFFCNEOKI-QINSGFPZSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
243.350 g/mol |
Nominal Mass |
243 u |
Quality |
873 |
Retention Index |
1871 |
SMILES |
C(\C(N1CCCC1)=C\C(C)C)(C1=CC=CC=C1)=O |
SPLASH |
splash10-00bl-9850000000-69b18517c56373fd8313 |
Sample Comments |
Double bond position uncertain, cis/trans isomerism unknown |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
a-Pyrrolidinoisohexaphenone-A (-2H)
4-methyl-1-phenyl-2-(pyrrolidin-1-yl)pent-2-en-1-one |
Technique |
GC/MS |
Wiley ID |
DD2024_023495 |