CID 418014

1-chloronaphthalen-2-amine

Structural Information

Molecular Formula
C10H8ClN
SMILES
C1=CC=C2C(=C1)C=CC(=C2Cl)N
InChI
InChI=1S/C10H8ClN/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-6H,12H2
InChIKey
ZTSYGXLLTYTXCS-UHFFFAOYSA-N
Compound name
1-chloronaphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

166
Patents

177.03453 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.04181 132.3
[M+Na]+ 200.02375 148.2
[M+NH4]+ 195.06835 143.4
[M+K]+ 215.99769 139.5
[M-H]- 176.02725 137.2
[M+Na-2H]- 198.00920 141.5
[M]+ 177.03398 136.5
[M]- 177.03508 136.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe