SpectraBase Compound ID | Hq3TUPPD3B5 |
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InChI | InChI=1S/C14H18FNO3/c1-10(2)6-5-9-19-14(18)13(17)16-12-8-4-3-7-11(12)15/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,16,17) |
InChIKey | YMVCNKZRCXUYMX-UHFFFAOYSA-N |
Mol Weight | 267.3 g/mol |
Molecular Formula | C14H18FNO3 |
Exact Mass | 267.127072 g/mol |
SpectraBase Spectrum ID | FeRMBzewuhN |
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Name | Oxalic acid, monoamide, N-(2-fluorophenyl)-, isohexyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 267.127071604 u |
Formula | C14H18FNO3 |
InChI | InChI=1S/C14H18FNO3/c1-10(2)6-5-9-19-14(18)13(17)16-12-8-4-3-7-11(12)15/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,16,17) |
InChIKey | YMVCNKZRCXUYMX-UHFFFAOYSA-N |
Molecular Weight | 267.300 g/mol |
SMILES | C(C(=O)NC1=C(C=CC=C1)F)(OCCCC(C)C)=O |