CID 23000230

(1-methyl-1h-indazol-6-yl)methanamine

Structural Information

Molecular Formula
C9H11N3
SMILES
CN1C2=C(C=CC(=C2)CN)C=N1
InChI
InChI=1S/C9H11N3/c1-12-9-4-7(5-10)2-3-8(9)6-11-12/h2-4,6H,5,10H2,1H3
InChIKey
SCHZPLZUVGWXMA-UHFFFAOYSA-N
Compound name
(1-methylindazol-6-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

161.09529 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.10257 131.8
[M+Na]+ 184.08451 142.8
[M-H]- 160.08801 134.2
[M+NH4]+ 179.12911 152.9
[M+K]+ 200.05845 139.3
[M+H-H2O]+ 144.09255 124.8
[M+HCOO]- 206.09349 156.4
[M+CH3COO]- 220.10914 146.2
[M+Na-2H]- 182.06996 139.6
[M]+ 161.09474 132.9
[M]- 161.09584 132.9
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