CID 82618300

1-{5-bromofuro[2,3-b]pyridin-2-yl}methanamine hydrochloride

Structural Information

Molecular Formula
C8H7BrN2O
SMILES
C1=C2C=C(OC2=NC=C1Br)CN
InChI
InChI=1S/C8H7BrN2O/c9-6-1-5-2-7(3-10)12-8(5)11-4-6/h1-2,4H,3,10H2
InChIKey
OSYCBLQVXBLELG-UHFFFAOYSA-N
Compound name
(5-bromofuro[2,3-b]pyridin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.97418 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.98146 139.0
[M+Na]+ 248.96340 153.1
[M-H]- 224.96690 146.0
[M+NH4]+ 244.00800 161.0
[M+K]+ 264.93734 142.9
[M+H-H2O]+ 208.97144 138.8
[M+HCOO]- 270.97238 161.8
[M+CH3COO]- 284.98803 155.4
[M+Na-2H]- 246.94885 148.7
[M]+ 225.97363 159.6
[M]- 225.97473 159.6
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.