CID 45122674

(5-methyl-1-benzofuran-2-yl)methanamine

Structural Information

Molecular Formula
C10H11NO
SMILES
CC1=CC2=C(C=C1)OC(=C2)CN
InChI
InChI=1S/C10H11NO/c1-7-2-3-10-8(4-7)5-9(6-11)12-10/h2-5H,6,11H2,1H3
InChIKey
LNHJWZLDJYOZGC-UHFFFAOYSA-N
Compound name
(5-methyl-1-benzofuran-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

161.08406 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.09134 130.6
[M+Na]+ 184.07328 144.5
[M+NH4]+ 179.11788 140.5
[M+K]+ 200.04722 139.6
[M-H]- 160.07678 135.5
[M+Na-2H]- 182.05873 137.6
[M]+ 161.08351 134.1
[M]- 161.08461 134.1
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