CID 5365900

4,8-decadien-3-ol, 5,9-dimethyl-

Structural Information

Molecular Formula
C12H22O
SMILES
CCC(/C=C(\C)/CCC=C(C)C)O
InChI
InChI=1S/C12H22O/c1-5-12(13)9-11(4)8-6-7-10(2)3/h7,9,12-13H,5-6,8H2,1-4H3/b11-9+
InChIKey
PQUSMVMWVMGVGN-PKNBQFBNSA-N
Compound name
(4E)-5,9-dimethyldeca-4,8-dien-3-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

34
Patents

182.16707 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.174346 148.2
[M+Na]+ 205.156288 152.7
[M-H]- 181.159794 146.5
[M+NH4]+ 200.200893 167.7
[M+K]+ 221.130228 150.7
[M+H-H2O]+ 165.164330 143.5
[M+HCOO]- 227.165271 166.3
[M+CH3COO]- 241.180921 184.0
[M+Na-2H]- 203.141736 147.9
[M]+ 182.16652142 147.8
[M]- 182.16761858 147.8
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