CID 63092037

1-(1-benzofuran-2-yl)cyclopropan-1-amine

Structural Information

Molecular Formula
C11H11NO
SMILES
C1CC1(C2=CC3=CC=CC=C3O2)N
InChI
InChI=1S/C11H11NO/c12-11(5-6-11)10-7-8-3-1-2-4-9(8)13-10/h1-4,7H,5-6,12H2
InChIKey
NIFUGNDCWNGZOD-UHFFFAOYSA-N
Compound name
1-(1-benzofuran-2-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.08406 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.09134 130.9
[M+Na]+ 196.07328 142.9
[M-H]- 172.07678 140.5
[M+NH4]+ 191.11788 149.6
[M+K]+ 212.04722 140.7
[M+H-H2O]+ 156.08132 125.8
[M+HCOO]- 218.08226 156.5
[M+CH3COO]- 232.09791 146.2
[M+Na-2H]- 194.05873 140.8
[M]+ 173.08351 134.9
[M]- 173.08461 134.9
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.