| SpectraBase Spectrum ID |
6n6Jq7vYsE6 |
| Name |
Xipamide-M (HO-)_neg |
| Collision Gas |
N2 |
| Comments |
FTMS - p ESI d Full ms2 [email protected] [50.00-395.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C15H15ClN2O5S |
| InChI |
InChI=1S/C15H15ClN2O5S/c1-7-3-9(19)4-8(2)14(7)18-15(21)10-5-13(24(17,22)23)11(16)6-12(10)20/h3-6,19-20H,1-2H3,(H,18,21)(H2,17,22,23) |
| InChIKey |
GOJUOIHCCGHJBC-UHFFFAOYSA-N |
| Inlet Type |
UHPLC |
| Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
| Ion Polarity |
N |
| Ionization Type |
HESI |
| Precursor Ion |
[M-H]- |
| SMILES |
N(C(C=1C(=CC(=C(S(=O)(=O)N)C1)Cl)O)=O)C1=C(C=C(C=C1C)O)C |
| Sample Comments |
The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Selected Ion Charge |
-1 |
| Source of Spectrum |
Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar |
| Spectrum Type |
ms2 |
| Technique |
HCD |
