CID 63321238

2-(5-bromopyrimidin-2-yl)propan-2-amine hydrochloride

Structural Information

Molecular Formula
C7H10BrN3
SMILES
CC(C)(C1=NC=C(C=N1)Br)N
InChI
InChI=1S/C7H10BrN3/c1-7(2,9)6-10-3-5(8)4-11-6/h3-4H,9H2,1-2H3
InChIKey
UIRDIGDIBQIMQP-UHFFFAOYSA-N
Compound name
2-(5-bromopyrimidin-2-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

54
Patents

215.00581 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.01309 137.9
[M+Na]+ 237.99503 149.8
[M-H]- 213.99853 141.6
[M+NH4]+ 233.03963 157.4
[M+K]+ 253.96897 138.7
[M+H-H2O]+ 198.00307 137.1
[M+HCOO]- 260.00401 157.0
[M+CH3COO]- 274.01966 186.5
[M+Na-2H]- 235.98048 147.4
[M]+ 215.00526 155.0
[M]- 215.00636 155.0
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