CID 5383549

3-(dimethylaminomethyl)-7-azaindole

Structural Information

Molecular Formula
C10H13N3
SMILES
CN(C)CC1=CNC2=C1C=CC=N2
InChI
InChI=1S/C10H13N3/c1-13(2)7-8-6-12-10-9(8)4-3-5-11-10/h3-6H,7H2,1-2H3,(H,11,12)
InChIKey
RFLCFQLBXWLHKX-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

244
Patents

175.11095 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.11823 136.4
[M+Na]+ 198.10017 145.7
[M-H]- 174.10367 138.9
[M+NH4]+ 193.14477 156.9
[M+K]+ 214.07411 142.9
[M+H-H2O]+ 158.10821 129.1
[M+HCOO]- 220.10915 160.3
[M+CH3COO]- 234.12480 150.1
[M+Na-2H]- 196.08562 144.3
[M]+ 175.11040 137.8
[M]- 175.11150 137.8
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.