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9,11,12,16-Tetraoxa-10-methyltricyclo[6.4.4.0(1,8)]hexadecane isomer
SpectraBase Compound ID 2RbWP1zyFZb
InChI InChI=1S/C13H22O4/c1-11-15-13-9-5-3-2-4-7-12(13,17-16-11)8-6-10-14-13/h11H,2-10H2,1H3
InChIKey LUIBYJXIBZHATR-UHFFFAOYSA-N
Mol Weight 242.31 g/mol
Molecular Formula C13H22O4
Exact Mass 242.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4gGtMAMe7r
Name 9,11,12,16-Tetraoxa-10-methyltricyclo[6.4.4.0(1,8)]hexadecane isomer
Alternate Name(s) 9,11,12,16-Tetraoxa-10-methyltricyclo[6.4.4.0(1,8)]hexadecane 11-Methyl-9,10,12,13-tetraoxatricyclo[6.4.4.0(1,8)]hexadecane
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Formula C13H22O4
InChI InChI=1S/C13H22O4/c1-11-15-13-9-5-3-2-4-7-12(13,17-16-11)8-6-10-14-13/h11H,2-10H2,1H3
InChIKey LUIBYJXIBZHATR-UHFFFAOYSA-N
Molecular Weight 242.315 g/mol
SMILES C123C(OOC(O3)C)(CCCO1)CCCCCC2
SPLASH splash10-0002-1900000000-85eb9ab5cbad93bfd016
Source of Spectrum H1-46-461-18
Wiley ID 816024