SpectraBase Spectrum ID |
KUoFNWMzUl5 |
Name |
Tirofiban artifact (+ME) |
Collision Gas |
N2 |
Comments |
FTMS + p ESI d Full ms2 [email protected] [50.00-480.00] |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C23H38N2O5S |
InChI |
InChI=1S/C23H38N2O5S/c1-3-4-17-31(27,28)25-22(23(26)29-2)18-20-8-10-21(11-9-20)30-16-6-5-7-19-12-14-24-15-13-19/h8-11,19,22,24-25H,3-7,12-18H2,1-2H3 |
InChIKey |
GAUQFJNEARCHEN-UHFFFAOYSA-N |
Inlet Type |
UHPLC |
Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
Ion Polarity |
P |
Ionization Type |
HESI |
Precursor Ion |
[M+H]+ |
SMILES |
N1CCC(CCCCOC2=CC=C(CC(C(OC)=O)NS(=O)(=O)CCCC)C=C2)CC1 |
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 |