| SpectraBase Spectrum ID |
9U9LeUQogy |
| Name |
Mycophenolic acid MS3_1 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [65.00-290.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C16H18O4/c1-5-9(2)6-7-11-14(17)13-12(8-20-16(13)18)10(3)15(11)19-4/h6H,1,5,7-8H2,2-4H3/p+1/b9-6+ |
| InChIKey |
ADOTZUJDSYZLEQ-RMKNXTFCSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC1=C(C\C=C\(C[CH2+])C)C(=C(C2=C1C(=O)OC2)C)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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
