SpectraBase Spectrum ID |
K48NoZVq3uS |
Name |
1-(Azepan-1-yl)hexane-1,2-dione |
Appearance |
Colorless oil |
Carrier Gas |
Argon |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
211.157228918 u |
Formula |
C12H21NO2 |
InChI |
InChI=1S/C12H21NO2/c1-2-3-8-11(14)12(15)13-9-6-4-5-7-10-13/h2-10H2,1H3 |
InChIKey |
WTSSYBZQMUHFMT-UHFFFAOYSA-N |
Instrument Name |
AMD 402 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.202200062 |
Molecular Weight |
211.305 g/mol |
Quality |
174 |
Reported Formula |
C12H21NO2 |
SMILES |
C(C(CCCC)=O)(=O)N1CCCCCC1 |
SPLASH |
splash10-004i-8910000000-7eba93a7f638cfd44252 |
Source of Spectrum |
ACI-61-SM21-3ab (DOI: 10.1002/anie.202200062) |
Thin-Layer Chromatography |
0.5 (pentane/EA, 5:1) |
Wiley ID |
1897566 |