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Cabergoline artifact (-COOH) 2ME
SpectraBase Compound ID 1OCaRkT1m8r
InChI InChI=1S/C20H24N2O2/c1-4-8-22-12-14(20(23)24-3)9-16-15-6-5-7-17-19(15)13(10-18(16)22)11-21(17)2/h4-7,11,14,16,18H,1,8-10,12H2,2-3H3
InChIKey YLAAOWRCWRUWDU-UHFFFAOYSA-N
Mol Weight 324.42 g/mol
Molecular Formula C20H24N2O2
Exact Mass 324.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AkiqvmIEKbI
Name Cabergoline artifact (-COOH) 2ME
Classification Dopamine antagonist
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Exact Mass 324.183778019 u
Formula C20H24N2O2
InChI InChI=1S/C20H24N2O2/c1-4-8-22-12-14(20(23)24-3)9-16-15-6-5-7-17-19(15)13(10-18(16)22)11-21(17)2/h4-7,11,14,16,18H,1,8-10,12H2,2-3H3
InChIKey YLAAOWRCWRUWDU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 324.424 g/mol
SMILES c1c2c3c(cc1)[n](cc3CC1C2CC(C(=O)OC)CN1CC=C)C
SPLASH splash10-0rk9-2921000000-0af83d5d7c8332976d64
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_8194