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
2
Annotation Hits

0
References

0
Patents

168.11504 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.12232 138.6
[M+Na]+ 191.10426 145.3
[M-H]- 167.10776 138.4
[M+NH4]+ 186.14886 159.4
[M+K]+ 207.07820 143.2
[M+H-H2O]+ 151.11230 133.7
[M+HCOO]- 213.11324 162.3
[M+CH3COO]- 227.12889 179.3
[M+Na-2H]- 189.08971 143.8
[M]+ 168.11449 142.2
[M]- 168.11559 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.