CID 6338061

F 2330

Structural Information

Molecular Formula
C15H20N10
SMILES
CC1=C(C(=NN1C(=N)N)C)N=NC2=CC=C(C=C2)/C(=N/N=C(N)N)/C
InChI
InChI=1S/C15H20N10/c1-8(20-23-14(16)17)11-4-6-12(7-5-11)21-22-13-9(2)24-25(10(13)3)15(18)19/h4-7H,1-3H3,(H3,18,19)(H4,16,17,23)/b20-8+,22-21?
InChIKey
BNDBNBYBJCVJLT-SXOIIDFLSA-N
Compound name
4-[[4-[(E)-N-(diaminomethylideneamino)-C-methylcarbonimidoyl]phenyl]diazenyl]-3,5-dimethylpyrazole-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.18726 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.19454 180.1
[M+Na]+ 363.17648 184.7
[M+NH4]+ 358.22108 183.6
[M+K]+ 379.15042 183.6
[M-H]- 339.17998 185.3
[M+Na-2H]- 361.16193 184.8
[M]+ 340.18671 181.2
[M]- 340.18781 181.2
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.