SpectraBase Compound ID | FgjUFXVHoo4 |
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InChI | InChI=1S/C13H24O3/c1-2-3-12-16-13(15)10-8-6-4-5-7-9-11-14/h11H,2-10,12H2,1H3 |
InChIKey | RKCDWVWCNXOCMW-UHFFFAOYSA-N |
Mol Weight | 228.33 g/mol |
Molecular Formula | C13H24O3 |
Exact Mass | 228.172545 g/mol |
SpectraBase Spectrum ID | 6uQbU9FoppQ |
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Name | Azelaaldehydic acid, butyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 228.172544630 u |
Formula | C13H24O3 |
InChI | InChI=1S/C13H24O3/c1-2-3-12-16-13(15)10-8-6-4-5-7-9-11-14/h11H,2-10,12H2,1H3 |
InChIKey | RKCDWVWCNXOCMW-UHFFFAOYSA-N |
Molecular Weight | 228.332 g/mol |
SMILES | C(C(OCCCC)=O)CCCCCCC=O |