SpectraBase Spectrum ID |
2dGMriZKPoz |
Name |
Fenetylline MS2 |
Comments |
F: ITMS + c ESI d w Full ms2 342.10 |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C18H23N5O2 |
InChI |
InChI=1S/C18H23N5O2/c1-13(11-14-7-5-4-6-8-14)19-9-10-23-12-20-16-15(23)17(24)22(3)18(25)21(16)2/h4-8,12-13,19H,9-11H2,1-3H3 |
InChIKey |
NMCHYWGKBADVMK-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
N(C(C)CC=1C=CC=CC1)CCN1C=2C(N(C)C(N(C)C2N=C1)=O)=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: Parent |
Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
Spectrum Type |
ms2 |
Technique |
ITMS |