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Bicyclo[3.1.0]hexan-2-one, 5-(1,1-dimethylethyl)-, (.+-.)-
SpectraBase Compound ID 63pJpB8Jp1L
InChI InChI=1S/C10H16O/c1-9(2,3)10-5-4-8(11)7(10)6-10/h7H,4-6H2,1-3H3
InChIKey ZFHUUIZLKLPLLB-UHFFFAOYSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIBPAZyM3Eo
Name Bicyclo[3.1.0]hexan-2-one, 5-(1,1-dimethylethyl)-, (.+-.)-
Alternate Name(s) 5-(1'-1'-dimethylethyl)bicyclo[3,10]hexan-2-one 5-tert-butylbicyclo[3.1.0]hexan-2-one
CAS Registry Number 113580-89-5
Comments Less than 3 mono-isotopic peaks
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Formula C10H16O
InChI InChI=1S/C10H16O/c1-9(2,3)10-5-4-8(11)7(10)6-10/h7H,4-6H2,1-3H3
InChIKey ZFHUUIZLKLPLLB-UHFFFAOYSA-N
Molecular Weight 152.237 g/mol
SMILES C12(C(C(=O)CC2)C1)C(C)(C)C
SPLASH splash10-0udr-0900000000-2fe6e7d5270fc20a9d26
Source of Spectrum B-40-1325-9
Wiley ID 1149924