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2-tert-Butylcyclooctanone

View entire compound with spectra: 1 MS (GC)

2-tert-Butylcyclooctanone
SpectraBase Compound ID G1IIacGsVyw
InChI InChI=1S/C12H22O/c1-12(2,3)10-8-6-4-5-7-9-11(10)13/h10H,4-9H2,1-3H3
InChIKey HNKDTYRLXXDOLO-UHFFFAOYSA-N
Mol Weight 182.31 g/mol
Molecular Formula C12H22O
Exact Mass 182.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83NDSrAKiWb
Name 2-tert-Butylcyclooctanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O
InChI InChI=1S/C12H22O/c1-12(2,3)10-8-6-4-5-7-9-11(10)13/h10H,4-9H2,1-3H3
InChIKey HNKDTYRLXXDOLO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19801131208
Molecular Weight 182.307 g/mol
SMILES C1CCC(C(CCC1)C(C)(C)C)=O
SPLASH splash10-054k-9400000000-18c3e725d133db48b7d0
Source of Spectrum K-113-3752-30
Synonyms 2-(tert-butyl)cyclooctan-1-one
Wiley ID 1792622