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3-(tert-butyl)cyclobutanone
SpectraBase Compound ID IWDbPutnoem
InChI InChI=1S/C8H14O/c1-8(2,3)6-4-7(9)5-6/h6H,4-5H2,1-3H3
InChIKey DUGBXGJNDWCDTG-UHFFFAOYSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IgS3BLP3ZBB
Name 3-(tert-butyl)cyclobutanone
Alternate Name(s) 3-Tert-butyl-1-cyclobutanone 3-Tert-butylcyclobutan-1-one
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Formula C8H14O
InChI InChI=1S/C8H14O/c1-8(2,3)6-4-7(9)5-6/h6H,4-5H2,1-3H3
InChIKey DUGBXGJNDWCDTG-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4sc01732c
Molecular Weight 126.199 g/mol
SMILES C1C(C(C)(C)C)CC1=O
SPLASH splash10-014i-9000000000-b267dca0ea84045c6d25
Source of Spectrum CSS-5-3983/SMS6-4q
Wiley ID 1755112