CID 219785

4-hydrazinyl-1-methyl-1h-pyrazolo[3,4-d]pyrimidine

Structural Information

Molecular Formula

C₆H₈N₆

SMILES

CN1C2=NC=NC(=C2C=N1)NN

InChI

InChI=1S/C6H8N6/c1-12-6-4(2-10-12)5(11-7)8-3-9-6/h2-3H,7H2,1H3,(H,8,9,11)

InChIKey

DZCWBKIIPGWKNI-UHFFFAOYSA-N

Compound name

(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2
Patents: 164.08104 Da
Monoisotopic Mass: -0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	165.08832	129.9
[M+Na]+	187.07026	142.2
[M+NH4]+	182.11486	137.0
[M+K]+	203.04420	139.1
[M-H]-	163.07376	130.7
[M+Na-2H]-	185.05571	136.6
[M]+	164.08049	131.5
[M]-	164.08159	131.5

Literature stripe

literature stripe

Patent stripe

patents stripe