CID 3154224

133280-80-5

Structural Information

Molecular Formula
C10H17N3
SMILES
CN(C)CCNCC1=CC=CC=N1
InChI
InChI=1S/C10H17N3/c1-13(2)8-7-11-9-10-5-3-4-6-12-10/h3-6,11H,7-9H2,1-2H3
InChIKey
DBEIHURZAFSRSR-UHFFFAOYSA-N
Compound name
N',N'-dimethyl-N-(pyridin-2-ylmethyl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

23
Patents

179.14224 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.149516 140.8
[M+Na]+ 202.131458 146.2
[M-H]- 178.134964 144.0
[M+NH4]+ 197.176063 159.5
[M+K]+ 218.105398 145.2
[M+H-H2O]+ 162.139500 133.0
[M+HCOO]- 224.140441 166.3
[M+CH3COO]- 238.156091 190.2
[M+Na-2H]- 200.116906 148.5
[M]+ 179.14169142 141.4
[M]- 179.14278858 141.4
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