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1,4-Dithiadispiro[4.2.5.2]pentadecane-9-carboxylic acid, 12-oxo-
SpectraBase Compound ID nBPcvr4oXk
InChI InChI=1S/C14H20O3S2/c15-10-1-2-11(12(16)17)13(9-10)3-5-14(6-4-13)18-7-8-19-14/h11H,1-9H2,(H,16,17)
InChIKey MHPSOPFAMLBYOL-UHFFFAOYSA-N
Mol Weight 300.43 g/mol
Molecular Formula C14H20O3S2
Exact Mass 300.085387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdKOPIVrh3
Name 1,4-Dithiadispiro[4.2.5.2]pentadecane-9-carboxylic acid, 12-oxo-
CAS Registry Number 108643-31-8
Comments Less than 3 mono-isotopic peaks
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Formula C14H20O3S2
InChI InChI=1S/C14H20O3S2/c15-10-1-2-11(12(16)17)13(9-10)3-5-14(6-4-13)18-7-8-19-14/h11H,1-9H2,(H,16,17)
InChIKey MHPSOPFAMLBYOL-UHFFFAOYSA-N
Molecular Weight 300.431 g/mol
SMILES OC(C1C2(CC(=O)CC1)CCC1(CC2)SCCS1)=O
SPLASH splash10-001i-0902000000-0ab20f8a29fb933df129
Source of Spectrum KC-1986-1511-0
Synonyms 12-oxo-1,4-dithiadispiro[4.2.5.2]pentadecane-9-carboxylic acid 9,9-Ethylenedithio-4-oxospiro[5.5[undecane-1-carboxylic acid
Wiley ID 1302532