CID 53021

Isovaleric acid, 2-(p-bromophenyl)hydrazide

Structural Information

Molecular Formula
C11H15BrN2O
SMILES
CC(C)CC(=O)NNC1=CC=C(C=C1)Br
InChI
InChI=1S/C11H15BrN2O/c1-8(2)7-11(15)14-13-10-5-3-9(12)4-6-10/h3-6,8,13H,7H2,1-2H3,(H,14,15)
InChIKey
UCGFWLWQVLRSCI-UHFFFAOYSA-N
Compound name
N'-(4-bromophenyl)-3-methylbutanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

270.03677 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.04405 153.1
[M+Na]+ 293.02599 154.2
[M+NH4]+ 288.07059 157.1
[M+K]+ 308.99993 154.5
[M-H]- 269.02949 154.1
[M+Na-2H]- 291.01144 155.8
[M]+ 270.03622 152.1
[M]- 270.03732 152.1
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

patents stripe