CID 62379772

2309447-10-5

Structural Information

Molecular Formula
C10H10BrNO
SMILES
CC1=C(OC2=C1C=C(C=C2)Br)CN
InChI
InChI=1S/C10H10BrNO/c1-6-8-4-7(11)2-3-9(8)13-10(6)5-12/h2-4H,5,12H2,1H3
InChIKey
HHMJJUYCEJXZEA-UHFFFAOYSA-N
Compound name
(5-bromo-3-methyl-1-benzofuran-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.99458 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.00186 145.4
[M+Na]+ 261.98380 149.8
[M+NH4]+ 257.02840 151.2
[M+K]+ 277.95774 150.6
[M-H]- 237.98730 148.2
[M+Na-2H]- 259.96925 148.3
[M]+ 238.99403 145.7
[M]- 238.99513 145.7
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.