CID 45078948

1-methyl-1h-indol-7-amine

Structural Information

Molecular Formula
C9H10N2
SMILES
CN1C=CC2=C1C(=CC=C2)N
InChI
InChI=1S/C9H10N2/c1-11-6-5-7-3-2-4-8(10)9(7)11/h2-6H,10H2,1H3
InChIKey
HDRIGWFONQYMGI-UHFFFAOYSA-N
Compound name
1-methylindol-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

52
Patents

146.0844 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.09168 126.9
[M+Na]+ 169.07362 138.0
[M-H]- 145.07712 130.8
[M+NH4]+ 164.11822 150.1
[M+K]+ 185.04756 134.6
[M+H-H2O]+ 129.08166 121.1
[M+HCOO]- 191.08260 152.9
[M+CH3COO]- 205.09825 142.1
[M+Na-2H]- 167.05907 134.9
[M]+ 146.08385 127.5
[M]- 146.08495 127.5
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