CID 43810924

5-(1-aminoethyl)-4-methylpyrimidin-2-amine

Structural Information

Molecular Formula
C7H12N4
SMILES
CC1=NC(=NC=C1C(C)N)N
InChI
InChI=1S/C7H12N4/c1-4(8)6-3-10-7(9)11-5(6)2/h3-4H,8H2,1-2H3,(H2,9,10,11)
InChIKey
GMVWRTAXMQPIBG-UHFFFAOYSA-N
Compound name
5-(1-aminoethyl)-4-methylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.1062 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.113476 133.5
[M+Na]+ 175.095418 141.9
[M-H]- 151.098924 134.3
[M+NH4]+ 170.140023 151.4
[M+K]+ 191.069358 139.8
[M+H-H2O]+ 135.103460 126.3
[M+HCOO]- 197.104401 156.0
[M+CH3COO]- 211.120051 182.3
[M+Na-2H]- 173.080866 138.8
[M]+ 152.10565142 130.4
[M]- 152.10674858 130.4
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

No patent data available for this compound.