| SpectraBase Spectrum ID |
A3GafR63b1s |
| Name |
6-(1,5-Dimethyl-1H-pyrrol-2-yl)-6-methyl-2-heptanone |
| CAS Registry Number |
102635-67-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H23NO |
| InChI |
InChI=1S/C14H23NO/c1-11-8-9-13(15(11)5)14(3,4)10-6-7-12(2)16/h8-9H,6-7,10H2,1-5H3 |
| InChIKey |
KJVPKRDBRQTRIC-UHFFFAOYSA-N |
| Molecular Weight |
221.344 g/mol |
| SMILES |
CC(=O)CCCC(C)(C)c1[n](c(cc1)C)C |
| SPLASH |
splash10-000i-0900000000-1bb176fa6b0018362836 |
| Source of Spectrum |
H-68-1112-11 |
| Synonyms |
2-Heptanone, 6-(1,5-dimethylpyrrol-2-yl)-6-methyl-
6-(1,5-dimethyl-2-pyrrolyl)-6-methyl-2-heptanone
6-(1,5-dimethylpyrrol-2-yl)-6-methyl-heptan-2-one |
| Wiley ID |
1221500 |
