CID 53906

77966-51-9

Structural Information

Molecular Formula
C14H21ClN2O
SMILES
CCN(CC)CC(=O)N(C)C1=C(C=CC=C1Cl)C
InChI
InChI=1S/C14H21ClN2O/c1-5-17(6-2)10-13(18)16(4)14-11(3)8-7-9-12(14)15/h7-9H,5-6,10H2,1-4H3
InChIKey
GSLHYEZCCTVOKP-UHFFFAOYSA-N
Compound name
N-(2-chloro-6-methylphenyl)-2-(diethylamino)-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.13425 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.14153 164.0
[M+Na]+ 291.12347 170.7
[M-H]- 267.12697 170.2
[M+NH4]+ 286.16807 182.5
[M+K]+ 307.09741 168.6
[M+H-H2O]+ 251.13151 157.6
[M+HCOO]- 313.13245 184.9
[M+CH3COO]- 327.14810 210.5
[M+Na-2H]- 289.10892 165.4
[M]+ 268.13370 169.7
[M]- 268.13480 169.7
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

patents stripe