CID 76222995

6-chloro-1,2,3,4-tetrahydronaphthalen-1-amine

Structural Information

Molecular Formula
C10H12ClN
SMILES
C1CC(C2=C(C1)C=C(C=C2)Cl)N
InChI
InChI=1S/C10H12ClN/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6,10H,1-3,12H2
InChIKey
MBBWLMFFVWVGIC-UHFFFAOYSA-N
Compound name
6-chloro-1,2,3,4-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

181.06583 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.07311 136.4
[M+Na]+ 204.05505 144.7
[M-H]- 180.05855 140.2
[M+NH4]+ 199.09965 158.1
[M+K]+ 220.02899 139.8
[M+H-H2O]+ 164.06309 131.7
[M+HCOO]- 226.06403 153.5
[M+CH3COO]- 240.07968 149.6
[M+Na-2H]- 202.04050 142.8
[M]+ 181.06528 133.7
[M]- 181.06638 133.7
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