| SpectraBase Spectrum ID |
5iFBJvgK2Sq |
| Name |
2-(3-azidopropyl)-2-(thiophen-2-ylmethyl)cyclohexane-1,3-dione |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
291.104147971 u |
| Formula |
C14H17N3O2S |
| InChI |
InChI=1S/C14H17N3O2S/c15-17-16-8-3-7-14(10-11-4-2-9-20-11)12(18)5-1-6-13(14)19/h2,4,9H,1,3,5-8,10H2 |
| InChIKey |
BQSWQHQXOKEOCM-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMSQP2010SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202107909 |
| Quality |
151 |
| SMILES |
C1(C(C(CCC1)=O)(CCCN=[N+]=[N-])CC=1SC=CC1)=O |
| SPLASH |
splash10-014i-2900000000-324a509b5ff6f1164440 |
| Source of Spectrum |
ACI-60-SM36-1k (DOI: 10.1002/anie.202107909) |
| Wiley ID |
1891345 |
