CID 18030

P-fluorobenzoic acid 2-isopropylhydrazide

Structural Information

Molecular Formula

C₁₀H₁₃FN₂O

SMILES

CC(C)NNC(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C10H13FN2O/c1-7(2)12-13-10(14)8-3-5-9(11)6-4-8/h3-7,12H,1-2H3,(H,13,14)

InChIKey

LHTLVTJXNDIKTE-UHFFFAOYSA-N

Compound name

4-fluoro-N'-propan-2-ylbenzohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 196.1012 Da
Monoisotopic Mass: 1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	197.10848	142.2
[M+Na]+	219.09042	148.2
[M-H]-	195.09392	144.5
[M+NH4]+	214.13502	160.9
[M+K]+	235.06436	146.4
[M+H-H2O]+	179.09846	134.8
[M+HCOO]-	241.09940	165.8
[M+CH3COO]-	255.11505	190.2
[M+Na-2H]-	217.07587	146.5
[M]+	196.10065	139.5
[M]-	196.10175	139.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe