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]+ 224.10700 148.1
[M+Na]+ 246.08894 156.7
[M-H]- 222.09244 156.5
[M+NH4]+ 241.13354 167.2
[M+K]+ 262.06288 153.4
[M+H-H2O]+ 206.09698 141.4
[M+HCOO]- 268.09792 173.0
[M+CH3COO]- 282.11357 161.9
[M+Na-2H]- 244.07439 155.3
[M]+ 223.09917 148.8
[M]- 223.10027 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