| SpectraBase Spectrum ID |
IfbE7obO2B1 |
| Name |
Pentylone AC |
| Classification |
Designer drug |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
277.131408092 u |
| Formula |
C15H19NO4 |
| InChI |
InChI=1S/C15H19NO4/c1-4-5-12(16(3)10(2)17)15(18)11-6-7-13-14(8-11)20-9-19-13/h6-8,12H,4-5,9H2,1-3H3 |
| InChIKey |
YEFDSHSTMSDFFO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
277.320 g/mol |
| SMILES |
c12OCOc2ccc(C(=O)C(CCC)N(C)C(=O)C)c1 |
| SPLASH |
splash10-000i-9400000000-485bdbb1ec082abcce31 |
| 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 |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_10455 |
