CID 16787243

889943-39-9

Structural Information

Molecular Formula
C6H8BrNO
SMILES
CNCC1=CC=C(O1)Br
InChI
InChI=1S/C6H8BrNO/c1-8-4-5-2-3-6(7)9-5/h2-3,8H,4H2,1H3
InChIKey
NANYLEFIVQMQHM-UHFFFAOYSA-N
Compound name
1-(5-bromofuran-2-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.97893 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.98621 136.0
[M+Na]+ 211.96815 138.2
[M+NH4]+ 207.01275 141.2
[M+K]+ 227.94209 139.9
[M-H]- 187.97165 137.8
[M+Na-2H]- 209.95360 138.5
[M]+ 188.97838 135.5
[M]- 188.97948 135.5
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.