CID 11008059

2-methyl-1h-indol-3-amine hydrochloride

Structural Information

Molecular Formula
C9H10N2
SMILES
CC1=C(C2=CC=CC=C2N1)N
InChI
InChI=1S/C9H10N2/c1-6-9(10)7-4-2-3-5-8(7)11-6/h2-5,11H,10H2,1H3
InChIKey
QYTPPLBWUMVALC-UHFFFAOYSA-N
Compound name
2-methyl-1H-indol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

30
Patents

146.0844 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.091676 127.4
[M+Na]+ 169.073618 138.0
[M-H]- 145.077124 129.9
[M+NH4]+ 164.118223 149.8
[M+K]+ 185.047558 133.8
[M+H-H2O]+ 129.081660 121.8
[M+HCOO]- 191.082601 151.8
[M+CH3COO]- 205.098251 141.9
[M+Na-2H]- 167.059066 134.9
[M]+ 146.08385142 126.1
[M]- 146.08494858 126.1
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