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]+ 188.04729 139.9
[M+Na]+ 210.02923 147.7
[M-H]- 186.03273 145.5
[M+NH4]+ 205.07383 161.2
[M+K]+ 226.00317 147.2
[M+H-H2O]+ 170.03727 134.8
[M+HCOO]- 232.03821 161.1
[M+CH3COO]- 246.05386 183.8
[M+Na-2H]- 208.01468 144.9
[M]+ 187.03946 144.5
[M]- 187.04056 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.