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3a-(1-methylcyclopropyl)-1,2,3,3a,4,5-hexahydropentalene
SpectraBase Compound ID D3wMSNQzAzp
InChI InChI=1S/C12H18/c1-11(8-9-11)12-6-2-4-10(12)5-3-7-12/h4H,2-3,5-9H2,1H3
InChIKey NMBXNUSYARFBTG-UHFFFAOYSA-N
Mol Weight 162.28 g/mol
Molecular Formula C12H18
Exact Mass 162.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AUFatPR2HlC
Name 3a-(1-methylcyclopropyl)-1,2,3,3a,4,5-hexahydropentalene
Comments Less than 3 mono-isotopic peaks
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Formula C12H18
InChI InChI=1S/C12H18/c1-11(8-9-11)12-6-2-4-10(12)5-3-7-12/h4H,2-3,5-9H2,1H3
InChIKey NMBXNUSYARFBTG-UHFFFAOYSA-N
Molecular Weight 162.276 g/mol
SMILES C1(C23C(=CCC3)CCC2)(CC1)C
SPLASH splash10-0006-9000000000-fd2656c02dce6b5c3aca
Source of Spectrum F-50-10889-37
Synonyms (3aR*)-3a-(1-Methylcyclopropyl)-1,2,3,3a,4,5-hexahydropentalene
Wiley ID 789353