| SpectraBase Spectrum ID |
BG2Gn6bgrGC |
| Name |
2-(3-azidopropyl)-2-(4-(trifluoromethyl)benzyl)cyclopentane-1,3-dione |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.119461254 u |
| Formula |
C16H16F3N3O2 |
| InChI |
InChI=1S/C16H16F3N3O2/c17-16(18,19)12-4-2-11(3-5-12)10-15(8-1-9-21-22-20)13(23)6-7-14(15)24/h2-5H,1,6-10H2 |
| InChIKey |
BSTQPCXDNLNSNL-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMSQP2010SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202107909 |
| Molecular Weight |
339.318 g/mol |
| Quality |
127 |
| SMILES |
C1(C(CCC1=O)=O)(CCCN=[N+]=[N-])CC1=CC=C(C=C1)C(F)(F)F |
| SPLASH |
splash10-00di-5900000000-8d0d2a0f7b990733f115 |
| Source of Spectrum |
ACI-60-SM41-3e (DOI: 10.1002/anie.202107909) |
| Wiley ID |
1891368 |
