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Bicyclo[13.1.0]hexadecan-2-one
SpectraBase Compound ID 863MYAen4ah
InChI InChI=1S/C16H28O/c17-16-12-10-8-6-4-2-1-3-5-7-9-11-14-13-15(14)16/h14-15H,1-13H2
InChIKey BIKRAVWBNXPMMM-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 6Mo1jnF9W8v
Name Bicyclo[13.1.0]hexadecan-2-one
CAS Registry Number 102572-89-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O
InChI InChI=1S/C16H28O/c17-16-12-10-8-6-4-2-1-3-5-7-9-11-14-13-15(14)16/h14-15H,1-13H2
InChIKey BIKRAVWBNXPMMM-UHFFFAOYSA-N
Molecular Weight 236.399 g/mol
SMILES C1CCCCCC(=O)C2C(CCCCCC1)C2
SPLASH splash10-05nb-9200000000-633e8b4167f1569367e8
Source of Spectrum J-51-2724-5
Synonyms (1S,15S)-Bicyclo[13.1.0]hexadecan-2-one 14-bicyclo[13.1.0]hexadecanone bicyclo[13.1.0]hexadecan-14-one
Wiley ID 1239050