CID 20315443

2-hydrazinyl-4-methylbenzoicacidhydrochloride

Structural Information

Molecular Formula

C₈H₁₀N₂O₂

SMILES

CC1=CC(=C(C=C1)C(=O)O)NN

InChI

InChI=1S/C8H10N2O2/c1-5-2-3-6(8(11)12)7(4-5)10-9/h2-4,10H,9H2,1H3,(H,11,12)

InChIKey

BVPBWGYLHIUZOB-UHFFFAOYSA-N

Compound name

2-hydrazinyl-4-methylbenzoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 166.07423 Da
Monoisotopic Mass: 0.3
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]+	167.08151	133.9
[M+Na]+	189.06345	144.1
[M+NH4]+	184.10805	141.2
[M+K]+	205.03739	139.8
[M-H]-	165.06695	135.7
[M+Na-2H]-	187.04890	139.3
[M]+	166.07368	135.5
[M]-	166.07478	135.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe