For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Ergoline-8-carboxylic acid, 9,10-didehydro-6-methyl-, (8.beta.)-
SpectraBase Compound ID AAvFS67N7oJ
InChI InChI=1S/C16H16N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-5,7,10,14,17H,6,8H2,1H3,(H,19,20)
InChIKey ZAGRKAFMISFKIO-UHFFFAOYSA-N
Mol Weight 268.32 g/mol
Molecular Formula C16H16N2O2
Exact Mass 268.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DbfC4kmmYFB
Name Ergoline-8-carboxylic acid, 9,10-didehydro-6-methyl-, (8.beta.)-
Alternate Name(s) 6-Methyl-9,10-didehydroergoline-8-carboxylic acid (+)-Lysergic acid D(+)-Lysergic acid D-Lysergic acid Ergoline-8-carboxylic acid, 9,10-didehydro-6-methyl-, (8beta)- Ergoline-8.beta.-carboxylic acid, 9,10-didehydro-6-methyl- Indolo[4,3-fg]quinoline, ergoline-8-carboxylic acid deriv. Lysergic acid DEA NO. 7300 EINECS 201-431-9
CAS Registry Number 82-58-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2O2
InChI InChI=1S/C16H16N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-5,7,10,14,17H,6,8H2,1H3,(H,19,20)
InChIKey ZAGRKAFMISFKIO-UHFFFAOYSA-N
Molecular Weight 268.316 g/mol
SMILES [nH]1c2cccc3c2c(CC2N(CC(C(O)=O)C=C32)C)c1
SPLASH splash10-00xr-1980000000-be3cb759bd9cb4b9aaf4
Source of Spectrum JZ-1992-1741-0
Wiley ID 1272349