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Carbonic acid, 2-chloroethyl neopentyl ester
SpectraBase Compound ID GqUu2YZ8bvl
InChI InChI=1S/C8H15ClO3/c1-8(2,3)6-12-7(10)11-5-4-9/h4-6H2,1-3H3
InChIKey NYIQAUKWXYWVSR-UHFFFAOYSA-N
Mol Weight 194.66 g/mol
Molecular Formula C8H15ClO3
Exact Mass 194.070972 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7YqFx7F19bF
Name Carbonic acid, 2-chloroethyl neopentyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 194.070972040 u
Formula C8H15ClO3
InChI InChI=1S/C8H15ClO3/c1-8(2,3)6-12-7(10)11-5-4-9/h4-6H2,1-3H3
InChIKey NYIQAUKWXYWVSR-UHFFFAOYSA-N
Molecular Weight 194.658 g/mol
SMILES C(COC(=O)OCC(C)(C)C)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954677