CID 5368785

(5e)-2,6-dimethylocta-5,7-dien-2-ol

Structural Information

Molecular Formula
C10H18O
SMILES
C/C(=C\CCC(C)(C)O)/C=C
InChI
InChI=1S/C10H18O/c1-5-9(2)7-6-8-10(3,4)11/h5,7,11H,1,6,8H2,2-4H3/b9-7+
InChIKey
IJFKZRMIRAVXRK-VQHVLOKHSA-N
Compound name
(5E)-2,6-dimethylocta-5,7-dien-2-ol
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

2
References

2101
Patents

154.13577 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.14305 137.7
[M+Na]+ 177.12499 143.8
[M-H]- 153.12849 136.4
[M+NH4]+ 172.16959 158.4
[M+K]+ 193.09893 141.8
[M+H-H2O]+ 137.13303 133.9
[M+HCOO]- 199.13397 156.8
[M+CH3COO]- 213.14962 177.2
[M+Na-2H]- 175.11044 141.7
[M]+ 154.13522 137.4
[M]- 154.13632 137.4
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