CID 7131837

2-chloro-n-(furan-2-ylmethyl)-n-phenylacetamide

Structural Information

Molecular Formula
C13H12ClNO2
SMILES
C1=CC=C(C=C1)N(CC2=CC=CO2)C(=O)CCl
InChI
InChI=1S/C13H12ClNO2/c14-9-13(16)15(10-12-7-4-8-17-12)11-5-2-1-3-6-11/h1-8H,9-10H2
InChIKey
BKRYXWOXOXWQPY-UHFFFAOYSA-N
Compound name
2-chloro-N-(furan-2-ylmethyl)-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.05565 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.06293 154.5
[M+Na]+ 272.04487 167.5
[M+NH4]+ 267.08947 163.3
[M+K]+ 288.01881 162.3
[M-H]- 248.04837 160.0
[M+Na-2H]- 270.03032 162.6
[M]+ 249.05510 158.1
[M]- 249.05620 158.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.