CID 22400274

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

Structural Information

Molecular Formula
C9H10BrN
SMILES
C1CC2=CC(=C(C=C2C1)Br)N
InChI
InChI=1S/C9H10BrN/c10-8-4-6-2-1-3-7(6)5-9(8)11/h4-5H,1-3,11H2
InChIKey
SZFFECLZIYWBBD-UHFFFAOYSA-N
Compound name
6-bromo-2,3-dihydro-1H-inden-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

210.99966 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.00694 140.9
[M+Na]+ 233.98888 152.8
[M-H]- 209.99238 147.8
[M+NH4]+ 229.03348 165.8
[M+K]+ 249.96282 141.2
[M+H-H2O]+ 193.99692 141.4
[M+HCOO]- 255.99786 162.5
[M+CH3COO]- 270.01351 156.4
[M+Na-2H]- 231.97433 147.4
[M]+ 210.99911 156.6
[M]- 211.00021 156.6
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