CID 4201

Minoxidil

Structural Information

Molecular Formula
C9H15N5O
SMILES
C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O
InChI
InChI=1S/C9H15N5O/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h6,11,15H,1-5,10H2
InChIKey
ZIMGGGWCDYVHOY-UHFFFAOYSA-N
Compound name
3-hydroxy-2-imino-6-piperidin-1-ylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

2078
References

34314
Patents

209.12766 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.13494 147.8
[M+Na]+ 232.11688 154.6
[M-H]- 208.12038 148.7
[M+NH4]+ 227.16148 161.0
[M+K]+ 248.09082 150.3
[M+H-H2O]+ 192.12492 138.8
[M+HCOO]- 254.12586 165.8
[M+CH3COO]- 268.14151 188.0
[M+Na-2H]- 230.10233 152.7
[M]+ 209.12711 140.1
[M]- 209.12821 140.1
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.