CID 155822409

2551116-32-4

Structural Information

Molecular Formula
C11H11N5
SMILES
CN1C(=C(C(=N1)C2=CC=CC=C2)C#N)NN
InChI
InChI=1S/C11H11N5/c1-16-11(14-13)9(7-12)10(15-16)8-5-3-2-4-6-8/h2-6,14H,13H2,1H3
InChIKey
USBKDSLELTWCJT-UHFFFAOYSA-N
Compound name
5-hydrazinyl-1-methyl-3-phenylpyrazole-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.10144 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.10872 148.4
[M+Na]+ 236.09066 158.5
[M-H]- 212.09416 151.0
[M+NH4]+ 231.13526 163.3
[M+K]+ 252.06460 154.0
[M+H-H2O]+ 196.09870 132.9
[M+HCOO]- 258.09964 168.9
[M+CH3COO]- 272.11529 159.1
[M+Na-2H]- 234.07611 152.4
[M]+ 213.10089 141.5
[M]- 213.10199 141.5
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.