CID 456213

Schembl6363206

Structural Information

Molecular Formula
C20H25N5
SMILES
CC(C)N=C(C1=CC2=C(C=C1)NC3=C2C=C(C=C3)C(=NC(C)C)N)N
InChI
InChI=1S/C20H25N5/c1-11(2)23-19(21)13-5-7-17-15(9-13)16-10-14(6-8-18(16)25-17)20(22)24-12(3)4/h5-12,25H,1-4H3,(H2,21,23)(H2,22,24)
InChIKey
SJINKEHZBDPQQW-UHFFFAOYSA-N
Compound name
3-N',6-N'-di(propan-2-yl)-9H-carbazole-3,6-dicarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1
Patents

335.211 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.21828 183.1
[M+Na]+ 358.20022 188.5
[M-H]- 334.20372 187.9
[M+NH4]+ 353.24482 198.4
[M+K]+ 374.17416 184.1
[M+H-H2O]+ 318.20826 174.8
[M+HCOO]- 380.20920 205.1
[M+CH3COO]- 394.22485 227.3
[M+Na-2H]- 356.18567 183.9
[M]+ 335.21045 181.5
[M]- 335.21155 181.6
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.