CID 12219

N-ethylmethylamine

Structural Information

Molecular Formula
C3H9N
SMILES
CCNC
InChI
InChI=1S/C3H9N/c1-3-4-2/h4H,3H2,1-2H3
InChIKey
LIWAQLJGPBVORC-UHFFFAOYSA-N
Compound name
N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

12
References

101502
Patents

59.073498 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 60.080774 108.9
[M+Na]+ 82.062716 116.4
[M-H]- 58.066222 109.7
[M+NH4]+ 77.107321 133.7
[M+K]+ 98.036656 117.2
[M+H-H2O]+ 42.070758 104.9
[M+HCOO]- 104.07170 134.6
[M+CH3COO]- 118.08735 162.9
[M+Na-2H]- 80.048164 117.9
[M]+ 59.072949 108.2
[M]- 59.074047 108.2
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