CID 22462813

2-phenylhydrazinecarboxylate

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

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

InChI

InChI=1S/C7H8N2O2/c10-7(11)9-8-6-4-2-1-3-5-6/h1-5,8-9H,(H,10,11)

InChIKey

POJYSQCMDUIYSB-UHFFFAOYSA-N

Compound name

anilinocarbamic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 79
Patents: 152.05858 Da
Monoisotopic Mass: 0.8
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]+	153.06586	130.0
[M+Na]+	175.04780	140.0
[M+NH4]+	170.09240	137.6
[M+K]+	191.02174	135.2
[M-H]-	151.05130	131.9
[M+Na-2H]-	173.03325	136.5
[M]+	152.05803	131.5
[M]-	152.05913	131.5

Literature stripe

literature stripe

Patent stripe

patents stripe