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]+ 179.12912 139.5
[M+Na]+ 201.11106 147.2
[M-H]- 177.11456 141.8
[M+NH4]+ 196.15566 156.8
[M+K]+ 217.08500 144.3
[M+H-H2O]+ 161.11910 130.6
[M+HCOO]- 223.12004 159.9
[M+CH3COO]- 237.13569 151.7
[M+Na-2H]- 199.09651 143.5
[M]+ 178.12129 135.4
[M]- 178.12239 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