CID 21156718

(4-chlorophenyl)(thiophen-3-yl)methanamine hydrochloride

Structural Information

Molecular Formula
C11H10ClNS
SMILES
C1=CC(=CC=C1C(C2=CSC=C2)N)Cl
InChI
InChI=1S/C11H10ClNS/c12-10-3-1-8(2-4-10)11(13)9-5-6-14-7-9/h1-7,11H,13H2
InChIKey
BPTMKNYVUJRAEA-UHFFFAOYSA-N
Compound name
(4-chlorophenyl)-thiophen-3-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.02225 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.02953 146.4
[M+Na]+ 246.01147 159.6
[M+NH4]+ 241.05607 157.0
[M+K]+ 261.98541 151.5
[M-H]- 222.01497 151.8
[M+Na-2H]- 243.99692 154.8
[M]+ 223.02170 150.6
[M]- 223.02280 150.6
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

No patent data available for this compound.