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2(1H)-Benzocyclododecenone, tetradecahydro-, (4aR*,14aS*)-
SpectraBase Compound ID DSrlkvSSABy
InChI InChI=1S/C16H28O/c17-16-12-11-14-9-7-5-3-1-2-4-6-8-10-15(14)13-16/h14-15H,1-13H2
InChIKey ABCZRZONYUNVHN-UHFFFAOYSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7psdrutLDc
Name 2(1H)-Benzocyclododecenone, tetradecahydro-, (4aR*,14aS*)-
CAS Registry Number 62841-25-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O
InChI InChI=1S/C16H28O/c17-16-12-11-14-9-7-5-3-1-2-4-6-8-10-15(14)13-16/h14-15H,1-13H2
InChIKey ABCZRZONYUNVHN-UHFFFAOYSA-N
Molecular Weight 236.399 g/mol
SMILES C12CC(=O)CCC2CCCCCCCCCC1
SPLASH splash10-0a5j-9240000000-ac547ea3da1b87c68c6a
Source of Spectrum KC-1977-264-0
Synonyms (1RS,12SR)-bicyclo(10.4.0)hexadecane-14-one (1RS,12RS)bicyclo(10.4.0) hexadecan-14-one Tetradecahydrobenzo[a]cyclododecen-2(1H)-one
Wiley ID 1239011