CID 3068044

3-(2-(dimethylamino)ethylamino)indazole

Structural Information

Molecular Formula
C11H16N4
SMILES
CN(C)CCNC1=NNC2=CC=CC=C21
InChI
InChI=1S/C11H16N4/c1-15(2)8-7-12-11-9-5-3-4-6-10(9)13-14-11/h3-6H,7-8H2,1-2H3,(H2,12,13,14)
InChIKey
WGACVTNJAJTWFD-UHFFFAOYSA-N
Compound name
N-(1H-indazol-3-yl)-N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

204.1375 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.14478 144.1
[M+Na]+ 227.12672 151.9
[M-H]- 203.13022 146.3
[M+NH4]+ 222.17132 162.9
[M+K]+ 243.10066 148.9
[M+H-H2O]+ 187.13476 136.0
[M+HCOO]- 249.13570 168.6
[M+CH3COO]- 263.15135 191.6
[M+Na-2H]- 225.11217 152.0
[M]+ 204.13695 145.1
[M]- 204.13805 145.1
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

patents stripe