CID 12513770

[(1h-indol-4-yl)methyl](methyl)amine

Structural Information

Molecular Formula
C10H12N2
SMILES
CNCC1=C2C=CNC2=CC=C1
InChI
InChI=1S/C10H12N2/c1-11-7-8-3-2-4-10-9(8)5-6-12-10/h2-6,11-12H,7H2,1H3
InChIKey
DPXOSZVHVILMJI-UHFFFAOYSA-N
Compound name
1-(1H-indol-4-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

160.10005 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.107326 131.4
[M+Na]+ 183.089268 140.5
[M-H]- 159.092774 133.8
[M+NH4]+ 178.133873 153.1
[M+K]+ 199.063208 136.4
[M+H-H2O]+ 143.097310 125.2
[M+HCOO]- 205.098251 156.1
[M+CH3COO]- 219.113901 145.3
[M+Na-2H]- 181.074716 140.1
[M]+ 160.09950142 131.0
[M]- 160.10059858 131.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe