| SpectraBase Spectrum ID |
1Yy6dOcawd |
| Name |
Metofenazate-M (dechloro-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 564.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C31H37N3O5S |
| InChI |
InChI=1S/C31H37N3O5S/c1-36-26-21-23(22-27(37-2)30(26)38-3)31(35)39-20-19-33-17-15-32(16-18-33)13-8-14-34-24-9-4-6-11-28(24)40-29-12-7-5-10-25(29)34/h4-7,9-12,21-22H,8,13-20H2,1-3H3 |
| InChIKey |
IZOFGUURFIMQAV-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C1=2N(C3=C(SC2C=CC=C1)C=CC=C3)CCCN1CCN(CC1)CCOC(C1=CC(=C(C(=C1)OC)OC)OC)=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 |
ms2 |
| Technique |
ITMS |
