| SpectraBase Spectrum ID |
99L6mV5MK8 |
| Name |
Aceprometazine MS2 |
| CAS Registry Number |
13461-01-3 |
| Comments |
F: ITMS + c ESI d w Full ms2 327.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C19H22N2OS |
| InChI |
InChI=1S/C19H22N2OS/c1-13(20(3)4)12-21-16-7-5-6-8-18(16)23-19-10-9-15(14(2)22)11-17(19)21/h5-11,13H,12H2,1-4H3 |
| InChIKey |
XLOQNFNTQIRSOX-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C12=C(C=CC(=C2)C(C)=O)SC=2C(=CC=CC2)N1CC(N(C)C)C |
| 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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms2 |
| Technique |
ITMS |
