CID 458587

N-tetradecylurea

Structural Information

Molecular Formula
C15H32N2O
SMILES
CCCCCCCCCCCCCCNC(=O)N
InChI
InChI=1S/C15H32N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-15(16)18/h2-14H2,1H3,(H3,16,17,18)
InChIKey
IPOBMWQSKXACEW-UHFFFAOYSA-N
Compound name
tetradecylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

323
Patents

256.25146 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.25874 170.0
[M+Na]+ 279.24068 171.8
[M-H]- 255.24418 168.0
[M+NH4]+ 274.28528 186.1
[M+K]+ 295.21462 169.1
[M+H-H2O]+ 239.24872 162.8
[M+HCOO]- 301.24966 191.6
[M+CH3COO]- 315.26531 204.7
[M+Na-2H]- 277.22613 170.3
[M]+ 256.25091 172.0
[M]- 256.25201 172.0
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.