CID 4961809

75228-67-0

Structural Information

Molecular Formula
C8H10ClNO2
SMILES
CN(CC1=CC=CO1)C(=O)CCl
InChI
InChI=1S/C8H10ClNO2/c1-10(8(11)5-9)6-7-3-2-4-12-7/h2-4H,5-6H2,1H3
InChIKey
FAGBTYDGNLOABD-UHFFFAOYSA-N
Compound name
2-chloro-N-(furan-2-ylmethyl)-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.04001 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.047286 139.9
[M+Na]+ 210.029228 147.7
[M-H]- 186.032734 145.5
[M+NH4]+ 205.073833 161.2
[M+K]+ 226.003168 147.2
[M+H-H2O]+ 170.037270 134.8
[M+HCOO]- 232.038211 161.1
[M+CH3COO]- 246.053861 183.8
[M+Na-2H]- 208.014676 144.9
[M]+ 187.03946142 144.5
[M]- 187.04055858 144.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.