CID 67023940

(5-bromo-2,3-dihydro-1h-inden-1-yl)methanamine

Structural Information

Molecular Formula
C10H12BrN
SMILES
C1CC2=C(C1CN)C=CC(=C2)Br
InChI
InChI=1S/C10H12BrN/c11-9-3-4-10-7(5-9)1-2-8(10)6-12/h3-5,8H,1-2,6,12H2
InChIKey
VWQZJOMQTCXOCG-UHFFFAOYSA-N
Compound name
(5-bromo-2,3-dihydro-1H-inden-1-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

225.0153 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.02258 145.4
[M+Na]+ 248.00452 147.8
[M+NH4]+ 243.04912 151.6
[M+K]+ 263.97846 148.2
[M-H]- 224.00802 147.1
[M+Na-2H]- 245.98997 147.7
[M]+ 225.01475 145.0
[M]- 225.01585 145.0
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