CID 20275

1-iodononane

Structural Information

Molecular Formula
C9H19I
SMILES
CCCCCCCCCI
InChI
InChI=1S/C9H19I/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H3
InChIKey
OGSJMFCWOUHXHN-UHFFFAOYSA-N
Compound name
1-iodononane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

28
References

959
Patents

254.05315 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.06043 147.6
[M+Na]+ 277.04237 146.5
[M-H]- 253.04587 140.6
[M+NH4]+ 272.08697 164.3
[M+K]+ 293.01631 151.0
[M+H-H2O]+ 237.05041 139.1
[M+HCOO]- 299.05135 165.1
[M+CH3COO]- 313.06700 188.1
[M+Na-2H]- 275.02782 140.2
[M]+ 254.05260 147.5
[M]- 254.05370 147.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe