CID 22400278

6-chloro-2,3-dihydro-1h-inden-5-amine

Structural Information

Molecular Formula
C9H10ClN
SMILES
C1CC2=CC(=C(C=C2C1)Cl)N
InChI
InChI=1S/C9H10ClN/c10-8-4-6-2-1-3-7(6)5-9(8)11/h4-5H,1-3,11H2
InChIKey
GVNFSQOSVGQWNQ-UHFFFAOYSA-N
Compound name
6-chloro-2,3-dihydro-1H-inden-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

167.05017 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.057446 133.6
[M+Na]+ 190.039388 143.3
[M-H]- 166.042894 137.9
[M+NH4]+ 185.083993 157.8
[M+K]+ 206.013328 138.5
[M+H-H2O]+ 150.047430 129.4
[M+HCOO]- 212.048371 153.2
[M+CH3COO]- 226.064021 147.9
[M+Na-2H]- 188.024836 138.9
[M]+ 167.04962142 132.6
[M]- 167.05071858 132.6
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

patents stripe