| SpectraBase Spectrum ID |
6LBCb4Yy00 |
| Name |
Avanafil MS3_2 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [85.00-360.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C17H21ClN4O2/c1-24-15-5-4-12(9-14(15)18)10-20-16-6-7-19-17(21-16)22-8-2-3-13(22)11-23/h4-7,9,13,23H,2-3,8,10-11H2,1H3,(H,19,20,21)/p+1 |
| InChIKey |
DVAHKWQEUJRPCN-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[NH2+](CC=1C=CC(=C(C1)Cl)OC)C=1C=CN=C(N2C(CO)CCC2)N1 |
| 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 |
ms3 |
| Technique |
ITMS |
