CID 50989505

2,4-di(aminoguanidine)-6-methylpyrimidine sulfate

Structural Information

Molecular Formula
C7H14N10
SMILES
CC1=CC(=NC(=N1)/N=C(\N)/NN)N=C(N)NN
InChI
InChI=1S/C7H14N10/c1-3-2-4(13-5(8)16-10)14-7(12-3)15-6(9)17-11/h2H,10-11H2,1H3,(H6,8,9,12,13,14,15,16,17)
InChIKey
WDAJQVHSAKUKPI-UHFFFAOYSA-N
Compound name
1-amino-2-[2-[(E)-[amino(hydrazinyl)methylidene]amino]-6-methylpyrimidin-4-yl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.14029 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.14757 148.6
[M+Na]+ 261.12951 153.6
[M-H]- 237.13301 151.8
[M+NH4]+ 256.17411 161.7
[M+K]+ 277.10345 153.0
[M+H-H2O]+ 221.13755 138.6
[M+HCOO]- 283.13849 178.1
[M+CH3COO]- 297.15414 215.6
[M+Na-2H]- 259.11496 154.5
[M]+ 238.13974 140.9
[M]- 238.14084 140.9
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.