CID 18622542

8-bromo-1,2,3,4-tetrahydronaphthalen-2-amine hydrochloride

Structural Information

Molecular Formula
C10H12BrN
SMILES
C1CC2=C(CC1N)C(=CC=C2)Br
InChI
InChI=1S/C10H12BrN/c11-10-3-1-2-7-4-5-8(12)6-9(7)10/h1-3,8H,4-6,12H2
InChIKey
YNXLDZYAFGPNHL-UHFFFAOYSA-N
Compound name
8-bromo-1,2,3,4-tetrahydronaphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

225.0153 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.02258 142.7
[M+Na]+ 248.00452 153.0
[M-H]- 224.00802 149.1
[M+NH4]+ 243.04912 165.1
[M+K]+ 263.97846 141.3
[M+H-H2O]+ 208.01256 142.8
[M+HCOO]- 270.01350 161.8
[M+CH3COO]- 284.02915 157.1
[M+Na-2H]- 245.98997 150.1
[M]+ 225.01475 156.7
[M]- 225.01585 156.7
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