CID 53408441

1247645-16-4

Structural Information

Molecular Formula
C9H14N4
SMILES
CC1=CC(=NC(=N1)N2CCCC2)N
InChI
InChI=1S/C9H14N4/c1-7-6-8(10)12-9(11-7)13-4-2-3-5-13/h6H,2-5H2,1H3,(H2,10,11,12)
InChIKey
DMTHAPGLGQMHGT-UHFFFAOYSA-N
Compound name
6-methyl-2-pyrrolidin-1-ylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

178.12184 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.129116 139.5
[M+Na]+ 201.111058 147.2
[M-H]- 177.114564 141.8
[M+NH4]+ 196.155663 156.8
[M+K]+ 217.084998 144.3
[M+H-H2O]+ 161.119100 130.6
[M+HCOO]- 223.120041 159.9
[M+CH3COO]- 237.135691 151.7
[M+Na-2H]- 199.096506 143.5
[M]+ 178.12129142 135.4
[M]- 178.12238858 135.4
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