CID 59014

101832-82-0

Structural Information

Molecular Formula
C13H19N3
SMILES
CC(CC1=CNC2=C1C=C(C=C2)N(C)C)N
InChI
InChI=1S/C13H19N3/c1-9(14)6-10-8-15-13-5-4-11(16(2)3)7-12(10)13/h4-5,7-9,15H,6,14H2,1-3H3
InChIKey
VQMVTEBMNHSUGD-UHFFFAOYSA-N
Compound name
3-(2-aminopropyl)-N,N-dimethyl-1H-indol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.1579 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.16518 150.7
[M+Na]+ 240.14712 158.4
[M-H]- 216.15062 154.1
[M+NH4]+ 235.19172 170.4
[M+K]+ 256.12106 155.1
[M+H-H2O]+ 200.15516 143.8
[M+HCOO]- 262.15610 174.2
[M+CH3COO]- 276.17175 196.3
[M+Na-2H]- 238.13257 154.4
[M]+ 217.15735 150.7
[M]- 217.15845 150.7
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.