CID 930618

610279-48-6

Structural Information

Molecular Formula
C13H14N6
SMILES
CC1=CC=C(C=C1)CN2C3=NC=NC(=C3C=N2)NN
InChI
InChI=1S/C13H14N6/c1-9-2-4-10(5-3-9)7-19-13-11(6-17-19)12(18-14)15-8-16-13/h2-6,8H,7,14H2,1H3,(H,15,16,18)
InChIKey
CDTKKVKZZZGALS-UHFFFAOYSA-N
Compound name
[1-[(4-methylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-yl]hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

254.12799 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.13527 156.0
[M+Na]+ 277.11721 170.4
[M+NH4]+ 272.16181 163.3
[M+K]+ 293.09115 165.3
[M-H]- 253.12071 159.7
[M+Na-2H]- 275.10266 164.8
[M]+ 254.12744 159.0
[M]- 254.12854 159.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.