CID 68696343

(7-chloronaphthalen-1-yl)methanamine hydrochloride

Structural Information

Molecular Formula
C11H10ClN
SMILES
C1=CC2=C(C=C(C=C2)Cl)C(=C1)CN
InChI
InChI=1S/C11H10ClN/c12-10-5-4-8-2-1-3-9(7-13)11(8)6-10/h1-6H,7,13H2
InChIKey
ALYVZNWEEXNADT-UHFFFAOYSA-N
Compound name
(7-chloronaphthalen-1-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

191.05017 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.05745 137.9
[M+Na]+ 214.03939 147.8
[M-H]- 190.04289 142.2
[M+NH4]+ 209.08399 159.3
[M+K]+ 230.01333 142.3
[M+H-H2O]+ 174.04743 133.0
[M+HCOO]- 236.04837 157.6
[M+CH3COO]- 250.06402 151.7
[M+Na-2H]- 212.02484 145.7
[M]+ 191.04962 138.5
[M]- 191.05072 138.5
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