![Allyl-[3-(trifluoromethyl)phenyl]amine](/api/spectrum/I2IeEsWCeiE/structure.png?h=300&w=458 "Allyl-[3-(trifluoromethyl)phenyl]amine")
| SpectraBase Compound ID | EAs2gNTmlhj |
|---|---|
| InChI | InChI=1S/C10H10F3N/c1-2-6-14-9-5-3-4-8(7-9)10(11,12)13/h2-5,7,14H,1,6H2 |
| InChIKey | DGJLLKBHFCFOOZ-UHFFFAOYSA-N |
| Mol Weight | 201.19 g/mol |
| Molecular Formula | C10H10F3N |
| Exact Mass | 201.076534 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | I2IeEsWCeiE |
|---|---|
| Name | Allyl-[3-(trifluoromethyl)phenyl]amine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.076533815 u |
| Formula | C10H10F3N |
| InChI | InChI=1S/C10H10F3N/c1-2-6-14-9-5-3-4-8(7-9)10(11,12)13/h2-5,7,14H,1,6H2 |
| InChIKey | DGJLLKBHFCFOOZ-UHFFFAOYSA-N |
| Molecular Weight | 201.192 g/mol |
| SMILES | C(C1=CC(NCC=C)=CC=C1)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939558 |