SpectraBase Spectrum ID |
30EuigGdaC |
Name |
Pergolide |
CAS Registry Number |
66104-22-1 |
Classification |
Antiparkinsonian |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
314.181670019 u |
Formula |
C19H26N2S |
InChI |
InChI=1S/C19H26N2S/c1-3-7-21-11-13(12-22-2)8-16-15-5-4-6-17-19(15)14(10-20-17)9-18(16)21/h4-6,10,13,16,18,20H,3,7-9,11-12H2,1-2H3 |
InChIKey |
YEHCICAEULNIGD-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
314.491 g/mol |
SMILES |
c12c3c(cccc3[nH]c1)C1C(C2)N(CC(CSC)C1)CCC |
SPLASH |
splash10-0j4r-3944000000-44053ad646beebd96d06 |
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_5627 |