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1-Cyclohexene-1-butanol, 5-(1,1-dimethylethyl)-, acetate
SpectraBase Compound ID DiTCgNEwrOR
InChI InChI=1S/C16H28O2/c1-13(17)18-11-6-5-8-14-9-7-10-15(12-14)16(2,3)4/h9,15H,5-8,10-12H2,1-4H3
InChIKey IUEUNTPFQNHXJX-UHFFFAOYSA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VVrNstEt4L
Name 1-Cyclohexene-1-butanol, 5-(1,1-dimethylethyl)-, acetate
Alternate Name(s) 4-(5'-t-butylcyclohex-1'-enyl)butyl acetate 4-(5-tert-butyl-1-cyclohexen-1-yl)butyl acetate
CAS Registry Number 69218-00-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-13(17)18-11-6-5-8-14-9-7-10-15(12-14)16(2,3)4/h9,15H,5-8,10-12H2,1-4H3
InChIKey IUEUNTPFQNHXJX-UHFFFAOYSA-N
Molecular Weight 252.398 g/mol
SMILES C1(C(C)(C)C)CC(CCCCOC(=O)C)=CCC1
SPLASH splash10-052r-9600000000-c88b7217eca5331d1a45
Source of Spectrum B-31-886-0
Wiley ID 1256113