CID 498729

Nsc634850

Structural Information

Molecular Formula
C6H15BrNP
SMILES
CC(C)N(C(C)C)PBr
InChI
InChI=1S/C6H15BrNP/c1-5(2)8(9-7)6(3)4/h5-6,9H,1-4H3
InChIKey
DKHFPHFUQYRFEY-UHFFFAOYSA-N
Compound name
N-bromophosphanyl-N-propan-2-ylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.01254 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.01982 153.6
[M+Na]+ 234.00176 162.9
[M-H]- 210.00526 156.8
[M+NH4]+ 229.04636 176.7
[M+K]+ 249.97570 154.0
[M+H-H2O]+ 194.00980 151.1
[M+HCOO]- 256.01074 178.7
[M+CH3COO]- 270.02639 194.1
[M+Na-2H]- 231.98721 154.0
[M]+ 211.01199 173.7
[M]- 211.01309 173.7
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.