| SpectraBase Spectrum ID |
77rXqteOXTT |
| Name |
Naphyrone-M (oxo-HO-alkyl-) MS3_2 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-265.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C16H14NO2/c18-15(11-17-9-3-6-16(17)19)14-8-7-12-4-1-2-5-13(12)10-14/h1-2,4-5,7-8,10-11H,3,6,9H2/q+1/b17-11+ |
| InChIKey |
YCIHMRNWANGCDM-GZTJUZNOSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C(\C=[N+]\1C(CCC1)=O)(C=1C=CC=2C(C1)=CC=CC2)=O |
| Sample Comments |
The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Sample Description |
Analyte Type: Metabolite |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
