CID 1382876

3-bromo-4-methylbenzohydrazide

Structural Information

Molecular Formula
C8H9BrN2O
SMILES
CC1=C(C=C(C=C1)C(=O)NN)Br
InChI
InChI=1S/C8H9BrN2O/c1-5-2-3-6(4-7(5)9)8(12)11-10/h2-4H,10H2,1H3,(H,11,12)
InChIKey
SVZACRLLIPEQOC-UHFFFAOYSA-N
Compound name
3-bromo-4-methylbenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

227.98982 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.99710 140.5
[M+Na]+ 250.97904 151.2
[M-H]- 226.98254 146.5
[M+NH4]+ 246.02364 161.4
[M+K]+ 266.95298 139.8
[M+H-H2O]+ 210.98708 139.3
[M+HCOO]- 272.98802 163.2
[M+CH3COO]- 287.00367 191.0
[M+Na-2H]- 248.96449 146.7
[M]+ 227.98927 156.6
[M]- 227.99037 156.6
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

patents stripe