| SpectraBase Spectrum ID |
Fb6BbDUEJT |
| Name |
3,5-CHMFUPPYCA MS3_2 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [60.00-275.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C14H14FN3O/c1-9(2)8-16-14(19)13-7-12(17-18-13)10-3-5-11(15)6-4-10/h3-9H,1-2H3,(H-,16,17,18,19)/p+1 |
| InChIKey |
LZGNYRRSPVFBOG-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N1N=C(C(N[CH+]C(C)C)=O)C=C1C=1C=CC(=CC1)F |
| 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 |
