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2-Ethyl-1-butanol, propionate
SpectraBase Compound ID 1bqc3ir9Uic
InChI InChI=1S/C9H18O2/c1-4-8(5-2)7-11-9(10)6-3/h8H,4-7H2,1-3H3
InChIKey YJKXXWQTIJDTET-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID IueKJ8XnxSK
Name 2-Ethyl-1-butanol, propionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 158.130679818 u
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-4-8(5-2)7-11-9(10)6-3/h8H,4-7H2,1-3H3
InChIKey YJKXXWQTIJDTET-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
SMILES CCC(=O)OCC(CC)CC
Spectrum/Structure Validation Score (Raman) 0.887937