| SpectraBase Spectrum ID |
KXDZLTeUlNG |
| Name |
1-(5-Butyl-2-isobutyl-1H-pyrrol-3-yl)-hexan-1-one |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.240564621 u |
| Formula |
C18H31NO |
| InChI |
InChI=1S/C18H31NO/c1-5-7-9-11-18(20)16-13-15(10-8-6-2)19-17(16)12-14(3)4/h13-14,19H,5-12H2,1-4H3 |
| InChIKey |
YQKJIOGNGLRYMO-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jo400533j |
| Molecular Weight |
277.452 g/mol |
| Quality |
121 |
| SMILES |
N1C(=CC(=C1CC(C)C)C(CCCCC)=O)CCCC |
| SPLASH |
splash10-06wc-2970000000-4cda2dd6baad1b61b226 |
| Source of Spectrum |
JOC-78-4927-7i (DOI: 10.1021/jo400533j) |
| Wiley ID |
1912148 |
