CID 3041470

Brn 0401875

Structural Information

Molecular Formula
C13H21N3O
SMILES
CCC(=O)N(C1=CC=CC=N1)C(C)CN(C)C
InChI
InChI=1S/C13H21N3O/c1-5-13(17)16(11(2)10-15(3)4)12-8-6-7-9-14-12/h6-9,11H,5,10H2,1-4H3
InChIKey
BOZCSBFQHOUTII-UHFFFAOYSA-N
Compound name
N-[1-(dimethylamino)propan-2-yl]-N-pyridin-2-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.16846 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.17574 157.7
[M+Na]+ 258.15768 161.8
[M-H]- 234.16118 162.1
[M+NH4]+ 253.20228 174.6
[M+K]+ 274.13162 162.4
[M+H-H2O]+ 218.16572 149.2
[M+HCOO]- 280.16666 181.1
[M+CH3COO]- 294.18231 205.0
[M+Na-2H]- 256.14313 160.6
[M]+ 235.16791 160.0
[M]- 235.16901 160.0
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.