CID 122866

Inh-palm

Structural Information

Molecular Formula

C₂₂H₃₇N₃O₂

SMILES

CCCCCCCCCCCCCCCC(=O)NNC(=O)C1=CC=NC=C1

InChI

InChI=1S/C22H37N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(26)24-25-22(27)20-16-18-23-19-17-20/h16-19H,2-15H2,1H3,(H,24,26)(H,25,27)

InChIKey

QSWPYIVJVYOTCN-UHFFFAOYSA-N

Compound name

N'-hexadecanoylpyridine-4-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1
Patents: 375.28857 Da
Monoisotopic Mass: 7.0
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]+	376.29585	199.4
[M+Na]+	398.27779	199.5
[M-H]-	374.28129	199.0
[M+NH4]+	393.32239	209.1
[M+K]+	414.25173	195.1
[M+H-H2O]+	358.28583	189.2
[M+HCOO]-	420.28677	219.2
[M+CH3COO]-	434.30242	224.8
[M+Na-2H]-	396.26324	199.1
[M]+	375.28802	202.9
[M]-	375.28912	202.9

Literature stripe

literature stripe

Patent stripe

patents stripe