CID 6442064

Nonen-3-ol, 2,2,8-trimethyl-

Structural Information

Molecular Formula
C12H24O
SMILES
CC(C)CCC/C=C(/C(C)(C)C)\O
InChI
InChI=1S/C12H24O/c1-10(2)8-6-7-9-11(13)12(3,4)5/h9-10,13H,6-8H2,1-5H3/b11-9-
InChIKey
PKDBKVJGYKPROI-LUAWRHEFSA-N
Compound name
(Z)-2,2,8-trimethylnon-3-en-3-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

184.18271 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.18999 148.5
[M+Na]+ 207.17193 153.4
[M-H]- 183.17543 147.0
[M+NH4]+ 202.21653 168.2
[M+K]+ 223.14587 152.0
[M+H-H2O]+ 167.17997 144.4
[M+HCOO]- 229.18091 165.9
[M+CH3COO]- 243.19656 184.4
[M+Na-2H]- 205.15738 150.2
[M]+ 184.18216 149.0
[M]- 184.18326 149.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.