CID 85661

2-dodecanamine, n,n-dimethyl-

Structural Information

Molecular Formula
C14H31N
SMILES
CCCCCCCCCCC(C)N(C)C
InChI
InChI=1S/C14H31N/c1-5-6-7-8-9-10-11-12-13-14(2)15(3)4/h14H,5-13H2,1-4H3
InChIKey
FMBFSCAZQQLLMD-UHFFFAOYSA-N
Compound name
N,N-dimethyldodecan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

213.24565 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.25293 160.6
[M+Na]+ 236.23487 163.6
[M-H]- 212.23837 161.0
[M+NH4]+ 231.27947 180.0
[M+K]+ 252.20881 163.1
[M+H-H2O]+ 196.24291 154.3
[M+HCOO]- 258.24385 182.3
[M+CH3COO]- 272.25950 200.7
[M+Na-2H]- 234.22032 161.5
[M]+ 213.24510 164.7
[M]- 213.24620 164.7
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

patents stripe