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]+ 174.091336 130.9
[M+Na]+ 196.073278 142.9
[M-H]- 172.076784 140.5
[M+NH4]+ 191.117883 149.6
[M+K]+ 212.047218 140.7
[M+H-H2O]+ 156.081320 125.8
[M+HCOO]- 218.082261 156.5
[M+CH3COO]- 232.097911 146.2
[M+Na-2H]- 194.058726 140.8
[M]+ 173.08351142 134.9
[M]- 173.08460858 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.