CID 117104888

O-[1-(3-bromophenyl)ethyl]hydroxylamine hydrochloride

Structural Information

Molecular Formula
C8H10BrNO
SMILES
CC(C1=CC(=CC=C1)Br)ON
InChI
InChI=1S/C8H10BrNO/c1-6(11-10)7-3-2-4-8(9)5-7/h2-6H,10H2,1H3
InChIKey
IGAORPMYAJWQJR-UHFFFAOYSA-N
Compound name
O-[1-(3-bromophenyl)ethyl]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.99458 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.00186 138.7
[M+Na]+ 237.98380 149.2
[M-H]- 213.98730 144.5
[M+NH4]+ 233.02840 160.3
[M+K]+ 253.95774 138.7
[M+H-H2O]+ 197.99184 138.2
[M+HCOO]- 259.99278 160.4
[M+CH3COO]- 274.00843 186.7
[M+Na-2H]- 235.96925 145.4
[M]+ 214.99403 156.1
[M]- 214.99513 156.1
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.