CID 121292

N,n-dimethylundecylamine

Structural Information

Molecular Formula
C13H29N
SMILES
CCCCCCCCCCCN(C)C
InChI
InChI=1S/C13H29N/c1-4-5-6-7-8-9-10-11-12-13-14(2)3/h4-13H2,1-3H3
InChIKey
MMWFTWUMBYZIRZ-UHFFFAOYSA-N
Compound name
N,N-dimethylundecan-1-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

2087
Patents

199.23 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.23728 155.3
[M+Na]+ 222.21922 158.9
[M-H]- 198.22272 155.7
[M+NH4]+ 217.26382 175.3
[M+K]+ 238.19316 158.3
[M+H-H2O]+ 182.22726 149.1
[M+HCOO]- 244.22820 178.3
[M+CH3COO]- 258.24385 196.9
[M+Na-2H]- 220.20467 158.0
[M]+ 199.22945 159.7
[M]- 199.23055 159.7
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