| SpectraBase Spectrum ID |
C2bNgpR37qx |
| Name |
Atracurium-M/artifact (464) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C20H23O4/c1-6-15-12-19(23-4)20(24-5)13-16(15)9-7-14-8-10-17(21-2)18(11-14)22-3/h6,8-13H,1,7H2,2-5H3/q+1 |
| InChIKey |
PCHVHYDOBMJFIT-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C=CC1=CC(=C(C=C1[CH+]CC1=CC(=C(C=C1)OC)OC)OC)OC |
| 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 |
ms3 |
| Technique |
ITMS |
