CID 387977

Curcumenol

Structural Information

Molecular Formula
C15H22O2
SMILES
CC1CCC2C13CC(=C(C)C)C(O3)(C=C2C)O
InChI
InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h7,11-12,16H,5-6,8H2,1-4H3
InChIKey
ISFMXVMWEWLJGJ-UHFFFAOYSA-N
Compound name
2,6-dimethyl-9-propan-2-ylidene-11-oxatricyclo[6.2.1.01,5]undec-6-en-8-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

18
References

1010
Patents

234.16199 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.16927 154.1
[M+Na]+ 257.15121 162.8
[M+NH4]+ 252.19581 166.0
[M+K]+ 273.12515 157.4
[M-H]- 233.15471 155.9
[M+Na-2H]- 255.13666 156.3
[M]+ 234.16144 156.0
[M]- 234.16254 156.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.