SpectraBase Compound ID | 7AS1P3XRPr8 |
---|---|
InChI | InChI=1S/C12H18FNO3/c1-15-10-7-9(3-5-14)8-11(16-2)12(10)17-6-4-13/h7-8H,3-6,14H2,1-2H3 |
InChIKey | RODJFRFKJSPAGG-UHFFFAOYSA-N |
Mol Weight | 243.28 g/mol |
Molecular Formula | C12H18FNO3 |
Exact Mass | 243.127072 g/mol |
SpectraBase Spectrum ID | 8rolqIRMfEB |
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Name | fe |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 243.127071604 u |
Formula | C12H18FNO3 |
InChI | InChI=1S/C12H18FNO3/c1-15-10-7-9(3-5-14)8-11(16-2)12(10)17-6-4-13/h7-8H,3-6,14H2,1-2H3 |
InChIKey | RODJFRFKJSPAGG-UHFFFAOYSA-N |
Molecular Weight | 243.278 g/mol |
SMILES | C=1(C(=CC(=CC1OC)CCN)OC)OCCF |