CID 439223

6,10-dodecadien-1-ol, 3,7,11-trimethyl-

Structural Information

Molecular Formula
C15H28O
SMILES
CC(CCC=C(C)CCC=C(C)C)CCO
InChI
InChI=1S/C15H28O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,15-16H,5-6,8,10-12H2,1-4H3
InChIKey
OOOOFOPLSIWRAR-UHFFFAOYSA-N
Compound name
3,7,11-trimethyldodeca-6,10-dien-1-ol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

4
References

389
Patents

224.21402 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.22130 161.1
[M+Na]+ 247.20324 169.0
[M+NH4]+ 242.24784 167.2
[M+K]+ 263.17718 162.9
[M-H]- 223.20674 159.3
[M+Na-2H]- 245.18869 161.5
[M]+ 224.21347 161.3
[M]- 224.21457 161.3
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

patents stripe