| SpectraBase Spectrum ID |
Azyy7ckVTqC |
| Name |
(-)-(S)-3-(4-Ethyl-3,8,10-trimethyl-2-oxo-1,11-dihydrodipyrrin-9-yl)butanoic acid |
| Alternate Name(s) |
(-)-(S)-3-(3-Ethyl-2,7,9-trimethyl-1-oxo-1,10-dihydrodipyrrin-8-yl)butanoic acid
(3S)-3-{5-[(Z)-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl}butanoic acid
(S)-3-{5-[3-Ethyl-4-methyl-5-oxo-1,5-dihydro-pyrrol-(2Z)-ylidenemethyl]-2,4-dimethyl-1H-pyrrol-3-yl}-butyric acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24N2O3 |
| InChI |
InChI=1S/C18H24N2O3/c1-6-13-10(3)18(23)20-15(13)8-14-11(4)17(12(5)19-14)9(2)7-16(21)22/h8-9,19H,6-7H2,1-5H3,(H,20,23)(H,21,22)/b15-8-/t9-/m0/s1 |
| InChIKey |
DZXIGVFASHREKL-AVPSXBMNSA-N |
| Molecular Weight |
316.401 g/mol |
| SMILES |
[nH]1c(c(c([C@](CC(=O)O)(C)[H])c1C)C)\C=C/1NC(C(=C1CC)C)=O |
| SPLASH |
splash10-066r-0059000000-e7edb2001958c3e5de31 |
| Source of Spectrum |
QC-6-2267-1 |
| Wiley ID |
883870 |
