CID 18524753

2-chloro-n-(cyclopropylmethyl)acetamide

Structural Information

Molecular Formula

C₆H₁₀ClNO

SMILES

C1CC1CNC(=O)CCl

InChI

InChI=1S/C6H10ClNO/c7-3-6(9)8-4-5-1-2-5/h5H,1-4H2,(H,8,9)

InChIKey

DSXCOZAXXDGYAX-UHFFFAOYSA-N

Compound name

2-chloro-N-(cyclopropylmethyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 147.04509 Da
Monoisotopic Mass: 0.9
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]+	148.052366	127.2
[M+Na]+	170.034308	136.1
[M-H]-	146.037814	131.6
[M+NH4]+	165.078913	144.2
[M+K]+	186.008248	132.7
[M+H-H2O]+	130.042350	122.2
[M+HCOO]-	192.043291	147.4
[M+CH3COO]-	206.058941	179.0
[M+Na-2H]-	168.019756	133.4
[M]+	147.04454142	130.6
[M]-	147.04563858	130.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe