CID 3691173

2-(3-bromophenoxy)propanehydrazide

Structural Information

Molecular Formula
C9H11BrN2O2
SMILES
CC(C(=O)NN)OC1=CC(=CC=C1)Br
InChI
InChI=1S/C9H11BrN2O2/c1-6(9(13)12-11)14-8-4-2-3-7(10)5-8/h2-6H,11H2,1H3,(H,12,13)
InChIKey
BIJXUYQEKVXPGQ-UHFFFAOYSA-N
Compound name
2-(3-bromophenoxy)propanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

258.0004 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.007676 148.6
[M+Na]+ 280.989618 157.6
[M-H]- 256.993124 154.0
[M+NH4]+ 276.034223 167.8
[M+K]+ 296.963558 146.9
[M+H-H2O]+ 240.997660 146.7
[M+HCOO]- 302.998601 170.2
[M+CH3COO]- 317.014251 195.6
[M+Na-2H]- 278.975066 153.7
[M]+ 257.99985142 165.4
[M]- 258.00094858 165.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.