CID 250609

N'-cyclopentylidenebenzohydrazide

Structural Information

Molecular Formula

C₁₂H₁₄N₂O

SMILES

C1CCC(=NNC(=O)C2=CC=CC=C2)C1

InChI

InChI=1S/C12H14N2O/c15-12(10-6-2-1-3-7-10)14-13-11-8-4-5-9-11/h1-3,6-7H,4-5,8-9H2,(H,14,15)

InChIKey

URIUOWGGBXGZKZ-UHFFFAOYSA-N

Compound name

N-(cyclopentylideneamino)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 202.11061 Da
Monoisotopic Mass: 1.8
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]+	203.11789	144.5
[M+Na]+	225.09983	148.9
[M-H]-	201.10333	151.9
[M+NH4]+	220.14443	164.8
[M+K]+	241.07377	146.7
[M+H-H2O]+	185.10787	137.0
[M+HCOO]-	247.10881	170.7
[M+CH3COO]-	261.12446	188.8
[M+Na-2H]-	223.08528	149.2
[M]+	202.11006	140.5
[M]-	202.11116	140.5

Literature stripe

literature stripe

Patent stripe

patents stripe