CID 6419129

1h-benz[f]indene-1,3(2h)-dione, bis[(diaminomethyl)hydrazone], (1z,3e)-

Structural Information

Molecular Formula
C15H20N8
SMILES
C\1/C(=N\NC(N)N)/C2=CC3=CC=CC=C3C=C2/C1=N\NC(N)N
InChI
InChI=1S/C15H20N8/c16-14(17)22-20-12-7-13(21-23-15(18)19)11-6-9-4-2-1-3-8(9)5-10(11)12/h1-6,14-15,22-23H,7,16-19H2/b20-12-,21-13+
InChIKey
VKAIHVUEHVSZES-AYRZQKSOSA-N
Compound name
N\""-[(Z)-[(3E)-3-(diaminomethylhydrazinylidene)cyclopenta[b]naphthalen-1-ylidene]amino]methanetriamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.1811 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.18838 158.1
[M+Na]+ 335.17032 161.7
[M-H]- 311.17382 164.3
[M+NH4]+ 330.21492 174.3
[M+K]+ 351.14426 159.5
[M+H-H2O]+ 295.17836 149.7
[M+HCOO]- 357.17930 186.4
[M+CH3COO]- 371.19495 231.8
[M+Na-2H]- 333.15577 163.9
[M]+ 312.18055 150.6
[M]- 312.18165 150.6
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.