CID 105535

2,6-nonadien-1-ol, formate, (2e,6z)-

Structural Information

Molecular Formula
C10H16O2
SMILES
CCC=CCCC=CCOC=O
InChI
InChI=1S/C10H16O2/c1-2-3-4-5-6-7-8-9-12-10-11/h3-4,7-8,10H,2,5-6,9H2,1H3
InChIKey
CUEUXDDPOMHZTF-UHFFFAOYSA-N
Compound name
nona-2,6-dienyl formate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

168.11504 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.122316 138.6
[M+Na]+ 191.104258 145.3
[M-H]- 167.107764 138.4
[M+NH4]+ 186.148863 159.4
[M+K]+ 207.078198 143.2
[M+H-H2O]+ 151.112300 133.7
[M+HCOO]- 213.113241 162.3
[M+CH3COO]- 227.128891 179.3
[M+Na-2H]- 189.089706 143.8
[M]+ 168.11449142 142.2
[M]- 168.11558858 142.2
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

No patent data available for this compound.