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(1R,5R)-7,7-Dimethyl-3-oxotricyclo[3.3.0.0(2,8)]octane-5-acetaldehyde
SpectraBase Compound ID DyGPkOUFelE
InChI InChI=1S/C12H16O2/c1-11(2)6-12(3-4-13)5-7(14)8-9(11)10(8)12/h4,8-10H,3,5-6H2,1-2H3/t8-,9+,10-,12+/m0/s1
InChIKey OVBQARQUNANPFG-MIZYBKAJSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ER3cb40TVzV
Name (1R,5R)-7,7-Dimethyl-3-oxotricyclo[3.3.0.0(2,8)]octane-5-acetaldehyde
Alternate Name(s) ((4aR,4bR)-2,2-dimethyl-3-oxohexahydrocyclopropa[cd]pentalen-4a(1H)-yl)acetaldehyde (1RS,2SR,5RS,8SR)-7,7-Dimethyl-3-oxotricyclo[3.3.0.0(2,8)]octane-5-acetaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-11(2)6-12(3-4-13)5-7(14)8-9(11)10(8)12/h4,8-10H,3,5-6H2,1-2H3/t8-,9+,10-,12+/m0/s1
InChIKey OVBQARQUNANPFG-MIZYBKAJSA-N
Molecular Weight 192.258 g/mol
SMILES [C@]12([C@@]3(C(C)(C)C[C@]2(CC([C@]13[H])=O)CC=O)[H])[H]
SPLASH splash10-014i-9000000000-b00d8753e1a319408a8f
Source of Spectrum E1-40-2692-6
Wiley ID 1551762