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7-Isopropyl-10-methyl-3-n-octyl-2,5-dioxaspiroundecene isomer
SpectraBase Compound ID 1uzeL1zXT4j
InChI InChI=1S/C21H40O2/c1-5-6-7-8-9-10-11-19-15-23-21(16-22-19)14-18(4)12-13-20(21)17(2)3/h17-20H,5-16H2,1-4H3
InChIKey VDLLWMYOQKQBDW-UHFFFAOYSA-N
Mol Weight 324.5 g/mol
Molecular Formula C21H40O2
Exact Mass 324.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lrzhheSw8h
Name 7-Isopropyl-10-methyl-3-n-octyl-2,5-dioxaspiroundecene isomer
Alternate Name(s) 7-isopropyl-10-methyl-3-octyl-1,4-dioxaspiro[5.5]undecane
CAS Registry Number 115404-94-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O2
InChI InChI=1S/C21H40O2/c1-5-6-7-8-9-10-11-19-15-23-21(16-22-19)14-18(4)12-13-20(21)17(2)3/h17-20H,5-16H2,1-4H3
InChIKey VDLLWMYOQKQBDW-UHFFFAOYSA-N
Molecular Weight 324.549 g/mol
SMILES C12(OCC(OC2)CCCCCCCC)C(CCC(C1)C)C(C)C
SPLASH splash10-0a4i-9043000000-7930e9e240f1f615e2a2
Source of Spectrum J-57-1419-4
Wiley ID 1323665