β-Iraldeine
CAS Registry Number®
127-43-5
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CAS Name
β-IraldeineMolecular Formula
C14H22OMolecular Mass
206.32Cite this Page
β-Iraldeine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=127-43-5 (retrieved ) (CAS RN: 127-43-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
133 °CDensity (2)
0.9338 g/cm³ @ Temp: 25 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h8-9H,5-7,10H2,1-4H3
InChIKey
InChIKey=LMWNGLDCJDIIBR-UHFFFAOYSA-N
SMILES
C(=CC(CC)=O)C=1C(C)(C)CCCC1C
Canonical SMILES
O=C(C=CC1=C(C)CCCC1(C)C)CC
Other Names for this Substance
- 1-Penten-3-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
- 1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one
- β-Iraldeine
- 5-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-4-penten-3-one
- NSC 163995
