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1,7-Dioxaspiro[5.5]undec-3-en-5-one, 3-methyl-2-(1-methylethyl)-, trans-(.+-.)-
SpectraBase Compound ID LjT3DJBNnLG
InChI InChI=1S/C13H20O3/c1-9(2)12-10(3)8-11(14)13(16-12)6-4-5-7-15-13/h8-9,12H,4-7H2,1-3H3/t12-,13+/m1/s1
InChIKey GPYHZHGWZVXRPF-OLZOCXBDSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0SFUDv5twi
Name 1,7-Dioxaspiro[5.5]undec-3-en-5-one, 3-methyl-2-(1-methylethyl)-, trans-(.+-.)-
Alternate Name(s) (2R,6S)-2-isopropyl-3-methyl-1,7-dioxaspiro[5.5]undec-3-en-5-one trans-3-methyl-2-(1-methylethyl)-1,7-dioxaspiro[5.5]undec-3-en-5-one
CAS Registry Number 112897-25-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-9(2)12-10(3)8-11(14)13(16-12)6-4-5-7-15-13/h8-9,12H,4-7H2,1-3H3/t12-,13+/m1/s1
InChIKey GPYHZHGWZVXRPF-OLZOCXBDSA-N
Molecular Weight 224.300 g/mol
SMILES [C@@]12(O[C@@](C(=CC2=O)C)(C(C)C)[H])OCCCC1
SPLASH splash10-0a4i-0900000000-33db297e15bc01fad7ca
Source of Spectrum C-110-1907-24
Wiley ID 1225282