SpectraBase Compound ID | AAVqXGEIzrB |
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InChI | InChI=1S/C15H21NO4/c1-11(2)7-6-10-20-15(18)14(17)16-12-8-4-5-9-13(12)19-3/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,16,17) |
InChIKey | AACQRKYVGCFOQM-UHFFFAOYSA-N |
Mol Weight | 279.34 g/mol |
Molecular Formula | C15H21NO4 |
Exact Mass | 279.147058 g/mol |
SpectraBase Spectrum ID | AVK6ikU0u5U |
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Name | Oxalic acid, monoamide, N-(2-methoxyphenyl)-, isohexyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 279.147058156 u |
Formula | C15H21NO4 |
InChI | InChI=1S/C15H21NO4/c1-11(2)7-6-10-20-15(18)14(17)16-12-8-4-5-9-13(12)19-3/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,16,17) |
InChIKey | AACQRKYVGCFOQM-UHFFFAOYSA-N |
Molecular Weight | 279.336 g/mol |
SMILES | C(COC(C(=O)NC1=C(OC)C=CC=C1)=O)CC(C)C |