CID 5287890

N-cyclopentyl-n-cyclobutylformamide

Structural Information

Molecular Formula

C₁₀H₁₇NO

SMILES

C1CCC(C1)N(C=O)C2CCC2

InChI

InChI=1S/C10H17NO/c12-8-11(10-6-3-7-10)9-4-1-2-5-9/h8-10H,1-7H2

InChIKey

DWGVYBRKKSJLNS-UHFFFAOYSA-N

Compound name

N-cyclobutyl-N-cyclopentylformamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 31
Patents: 167.13101 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]+	168.138286	134.5
[M+Na]+	190.120228	136.9
[M-H]-	166.123734	141.4
[M+NH4]+	185.164833	150.0
[M+K]+	206.094168	139.7
[M+H-H2O]+	150.128270	123.1
[M+HCOO]-	212.129211	156.6
[M+CH3COO]-	226.144861	186.1
[M+Na-2H]-	188.105676	137.3
[M]+	167.13046142	139.6
[M]-	167.13155858	139.6

Literature stripe

literature stripe

Patent stripe

patents stripe