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Trnas-4-methyl-1-ETHENYL1-acetoxycyclohexane

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Trnas-4-methyl-1-ETHENYL1-acetoxycyclohexane
SpectraBase Compound ID AMagIAOcOzl
InChI InChI=1S/C11H18O2/c1-4-11(13-10(3)12)7-5-9(2)6-8-11/h4,9H,1,5-8H2,2-3H3/t9-,11-
InChIKey XFARPBAPZOQBBA-HOMQSWHASA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ld8HOwavfVd
Name Trnas-4-methyl-1-ETHENYL1-acetoxycyclohexane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-4-11(13-10(3)12)7-5-9(2)6-8-11/h4,9H,1,5-8H2,2-3H3/t9-,11-
InChIKey XFARPBAPZOQBBA-HOMQSWHASA-N
Molecular Weight 182.263 g/mol
SMILES [C@]1(OC(=O)C)(C=C)CC[C@@](CC1)(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.936889