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2-Cyclohexene-1-acetic acid, 2,6-bis(1,1-dimethylethyl)-4-methylphenyl ester
SpectraBase Compound ID CUM5IciT2aX
InChI InChI=1S/C23H34O2/c1-16-13-18(22(2,3)4)21(19(14-16)23(5,6)7)25-20(24)15-17-11-9-8-10-12-17/h9,11,13-14,17H,8,10,12,15H2,1-7H3
InChIKey ZIVIDYIYHMPYOL-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C23H34O2
Exact Mass 342.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ZCiIjqzCJe
Name 2-Cyclohexene-1-acetic acid, 2,6-bis(1,1-dimethylethyl)-4-methylphenyl ester
Alternate Name(s) 2,6-Ditert-butyl-4-methylphenyl 2-cyclohexen-1-ylacetate 2,6-Ditert-butyl-4-methylphenyl 2-cyclohexenylacetate
CAS Registry Number 125640-93-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O2
InChI InChI=1S/C23H34O2/c1-16-13-18(22(2,3)4)21(19(14-16)23(5,6)7)25-20(24)15-17-11-9-8-10-12-17/h9,11,13-14,17H,8,10,12,15H2,1-7H3
InChIKey ZIVIDYIYHMPYOL-UHFFFAOYSA-N
Molecular Weight 342.523 g/mol
SMILES c1(c(C(C)(C)C)cc(cc1C(C)(C)C)C)OC(=O)CC1C=CCCC1
SPLASH splash10-05ai-9030000000-da779d0ba1bfc6614214
Source of Spectrum C-112-1911-5
Wiley ID 1337008