CID 89186

5,9-dimethyl-8-decen-3-ol

Structural Information

Molecular Formula
C12H24O
SMILES
CCC(CC(C)CCC=C(C)C)O
InChI
InChI=1S/C12H24O/c1-5-12(13)9-11(4)8-6-7-10(2)3/h7,11-13H,5-6,8-9H2,1-4H3
InChIKey
YBQNRPVINYKRGQ-UHFFFAOYSA-N
Compound name
5,9-dimethyldec-8-en-3-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

6
Patents

184.18271 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.189986 149.8
[M+Na]+ 207.171928 153.9
[M-H]- 183.175434 148.0
[M+NH4]+ 202.216533 169.2
[M+K]+ 223.145868 152.5
[M+H-H2O]+ 167.179970 145.0
[M+HCOO]- 229.180911 167.7
[M+CH3COO]- 243.196561 185.6
[M+Na-2H]- 205.157376 149.4
[M]+ 184.18216142 150.2
[M]- 184.18325858 150.2
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

patents stripe