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Trans-1,1-dimethylethyl 2,2-dimethoxy-3-methylcyclopropanecarboxylate
SpectraBase Compound ID KAvgtEmJ9dv
InChI InChI=1S/C11H20O4/c1-7-8(11(7,13-5)14-6)9(12)15-10(2,3)4/h7-8H,1-6H3/t7-,8+/m1/s1
InChIKey NXEVPMJSVHQBJX-SFYZADRCSA-N
Mol Weight 216.28 g/mol
Molecular Formula C11H20O4
Exact Mass 216.136159 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 288BWWsBBnH
Name Trans-1,1-dimethylethyl 2,2-dimethoxy-3-methylcyclopropanecarboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.136159120 u
Formula C11H20O4
InChI InChI=1S/C11H20O4/c1-7-8(11(7,13-5)14-6)9(12)15-10(2,3)4/h7-8H,1-6H3/t7-,8+/m1/s1
InChIKey NXEVPMJSVHQBJX-SFYZADRCSA-N
Molecular Weight 216.277 g/mol
SMILES C1([C@](C(OC(C)(C)C)=O)([C@]1(C)[H])[H])(OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963371