CID 82503823

(6-chloro-1h-indol-2-yl)methanamine hydrochloride

Structural Information

Molecular Formula
C9H9ClN2
SMILES
C1=CC2=C(C=C1Cl)NC(=C2)CN
InChI
InChI=1S/C9H9ClN2/c10-7-2-1-6-3-8(5-11)12-9(6)4-7/h1-4,12H,5,11H2
InChIKey
WWVAAHJCJQMGKD-UHFFFAOYSA-N
Compound name
(6-chloro-1H-indol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.04543 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.05271 133.4
[M+Na]+ 203.03465 147.5
[M+NH4]+ 198.07925 143.1
[M+K]+ 219.00859 141.7
[M-H]- 179.03815 136.1
[M+Na-2H]- 201.02010 140.5
[M]+ 180.04488 136.4
[M]- 180.04598 136.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.