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1-Isopropyl-4-methylcyclohex-4-yl thioacetate
SpectraBase Compound ID DSAqeMvYQcp
InChI InChI=1S/C12H22OS/c1-9(2)11-5-7-12(4,8-6-11)13-10(3)14/h9,11H,5-8H2,1-4H3
InChIKey CDDBMFQWKBAAGJ-UHFFFAOYSA-N
Mol Weight 214.37 g/mol
Molecular Formula C12H22OS
Exact Mass 214.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69k3VeYstZn
Name 1-Isopropyl-4-methylcyclohex-4-yl thioacetate
Alternate Name(s) O-(4-isopropyl-1-methylcyclohexyl) ethanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22OS
InChI InChI=1S/C12H22OS/c1-9(2)11-5-7-12(4,8-6-11)13-10(3)14/h9,11H,5-8H2,1-4H3
InChIKey CDDBMFQWKBAAGJ-UHFFFAOYSA-N
Molecular Weight 214.367 g/mol
SMILES C(=S)(OC1(CCC(CC1)C(C)C)C)C
SPLASH splash10-05nn-9100000000-d73b7387a7b8dc28ecd2
Source of Spectrum F-51-3049-12
Wiley ID 791338