CID 16244328

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

Structural Information

Molecular Formula
C10H12BrN
SMILES
C1CC(C2=C(C1)C=CC(=C2)Br)N
InChI
InChI=1S/C10H12BrN/c11-8-5-4-7-2-1-3-10(12)9(7)6-8/h4-6,10H,1-3,12H2
InChIKey
PHUSWQSCHYYQQF-UHFFFAOYSA-N
Compound name
7-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

87
Patents

225.0153 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.022576 142.7
[M+Na]+ 248.004518 153.0
[M-H]- 224.008024 149.1
[M+NH4]+ 243.049123 165.1
[M+K]+ 263.978458 141.3
[M+H-H2O]+ 208.012560 142.8
[M+HCOO]- 270.013501 161.8
[M+CH3COO]- 284.029151 157.1
[M+Na-2H]- 245.989966 150.1
[M]+ 225.01475142 156.7
[M]- 225.01584858 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