| SpectraBase Spectrum ID |
2rNV1bACTYr |
| Name |
2-(4-(Trifluoromethyl)cyclohexyl)isoindoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
269.139134073 u |
| Formula |
C15H18F3N |
| InChI |
InChI=1S/C15H18F3N/c16-15(17,18)13-5-7-14(8-6-13)19-9-11-3-1-2-4-12(11)10-19/h1-4,13-14H,5-10H2 |
| InChIKey |
QIKWMFPXCMPYLU-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202201078 |
| Molecular Weight |
269.311 g/mol |
| Quality |
59 |
| Reported Formula |
C15H18NF3 |
| SMILES |
C(C1CCC(CC1)N1CC2=C(C1)C=CC=C2)(F)(F)F |
| SPLASH |
splash10-0aor-0910000000-3236e0320d61d9877f41 |
| Sample Comments |
Diastereomer 2 |
| Source of Spectrum |
QE-28-SM15-18'' (DOI: 10.1002/chem.202201078) |
| Wiley ID |
1900470 |
