SpectraBase Spectrum ID |
KRw2WFJr0YF |
Name |
Pentamidine |
CAS Registry Number |
100-33-4 |
Classification |
Antibiotic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
340.189926027 u |
Formula |
C19H24N4O2 |
InChI |
InChI=1S/C19H24N4O2/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23) |
InChIKey |
XDRYMKDFEDOLFX-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
340.427 g/mol |
SMILES |
c1(ccc(C(=N)N)cc1)OCCCCCOc1ccc(C(N)=N)cc1 |
SPLASH |
splash10-014i-9600000000-ae7e167ff2555ec969d4 |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_1948 |