CID 91667073

14-azido-tetradecanoic acid

Structural Information

Molecular Formula
C14H27N3O2
SMILES
C(CCCCCCC(=O)O)CCCCCCN=[N+]=[N-]
InChI
InChI=1S/C14H27N3O2/c15-17-16-13-11-9-7-5-3-1-2-4-6-8-10-12-14(18)19/h1-13H2,(H,18,19)
InChIKey
BDKKINJEPJYWSL-UHFFFAOYSA-N
Compound name
14-azidotetradecanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

269.21033 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.21761 169.4
[M+Na]+ 292.19955 171.7
[M-H]- 268.20305 169.4
[M+NH4]+ 287.24415 185.1
[M+K]+ 308.17349 165.0
[M+H-H2O]+ 252.20759 166.6
[M+HCOO]- 314.20853 195.5
[M+CH3COO]- 328.22418 202.6
[M+Na-2H]- 290.18500 173.8
[M]+ 269.20978 171.1
[M]- 269.21088 171.1
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.