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methyl 2-(1-methylspiro[4.4]nonan-1-yl)propanoate
SpectraBase Compound ID 9Mtt5j1UzYZ
InChI InChI=1S/C14H24O2/c1-11(12(15)16-3)13(2)7-6-10-14(13)8-4-5-9-14/h11H,4-10H2,1-3H3
InChIKey ODVZMIREHPWHKA-UHFFFAOYSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLmE04A4BEx
Name methyl 2-(1-methylspiro[4.4]nonan-1-yl)propanoate
Appearance Colorless oil
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Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-11(12(15)16-3)13(2)7-6-10-14(13)8-4-5-9-14/h11H,4-10H2,1-3H3
InChIKey ODVZMIREHPWHKA-UHFFFAOYSA-N
Instrument Name MSD5975C
Ionization Type EI
Molecular Weight 224.344 g/mol
SMILES COC(=O)C(C1(C)C2(CCCC2)CCC1)C
SPLASH splash10-0019-9500000000-3fd564ad25c576f1bbc7
Sample Comments Major isomer, dr = 2.2:1
Source of Spectrum WO2017097884A1
Wiley ID 1855426