CID 3164027

(1-benzofuran-2-yl)(phenyl)methanamine hydrochloride

Structural Information

Molecular Formula
C15H13NO
SMILES
C1=CC=C(C=C1)C(C2=CC3=CC=CC=C3O2)N
InChI
InChI=1S/C15H13NO/c16-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)17-14/h1-10,15H,16H2
InChIKey
HJJRPYFDKVKGRQ-UHFFFAOYSA-N
Compound name
1-benzofuran-2-yl(phenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

223.09972 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.106996 148.1
[M+Na]+ 246.088938 156.7
[M-H]- 222.092444 156.5
[M+NH4]+ 241.133543 167.2
[M+K]+ 262.062878 153.4
[M+H-H2O]+ 206.096980 141.4
[M+HCOO]- 268.097921 173.0
[M+CH3COO]- 282.113571 161.9
[M+Na-2H]- 244.074386 155.3
[M]+ 223.09917142 148.8
[M]- 223.10026858 148.8
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