SpectraBase Spectrum ID |
2lTX325hlU8 |
Name |
1-(3,4-Methylenedioxyphenyl)l-2-pyrrolidinyl-1-butanone-A (-2H) |
Classification |
Designer drug artifact |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
259.120843408 u |
Formula |
C15H17NO3 |
InChI |
InChI=1S/C15H17NO3/c1-2-12(16-7-3-4-8-16)15(17)11-5-6-13-14(9-11)19-10-18-13/h3,5-7,9,12H,2,4,8,10H2,1H3 |
InChIKey |
XNYTYDKJWMHEKR-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
259.305 g/mol |
Nominal Mass |
259 u |
Quality |
948 |
Retention Index |
2172 |
SMILES |
C=1(C(C(N2C=CCC2)CC)=O)C=C2C(=CC1)OCO2 |
SPLASH |
splash10-03kc-9720000000-6c126d89bd2cfc378d8f |
Sample Comments |
Structure uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(1,3-benzodioxol-5-yl)-2-(2,3-dihydro-1H-pyrrol-1-yl)butan-1-one |
Technique |
GC/MS |
Wiley ID |
DD2024_010405 |