CID 59373

C 5384

Structural Information

Molecular Formula
C18H30ClN3O
SMILES
CCN(CC)CCN(CC(=O)NC1=C(C=CC=C1Cl)C)C(C)C
InChI
InChI=1S/C18H30ClN3O/c1-6-21(7-2)11-12-22(14(3)4)13-17(23)20-18-15(5)9-8-10-16(18)19/h8-10,14H,6-7,11-13H2,1-5H3,(H,20,23)
InChIKey
ZPFVQNHFWPNZBP-UHFFFAOYSA-N
Compound name
N-(2-chloro-6-methylphenyl)-2-[2-(diethylamino)ethyl-propan-2-ylamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.20773 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.21501 188.0
[M+Na]+ 362.19695 191.8
[M-H]- 338.20045 193.4
[M+NH4]+ 357.24155 203.1
[M+K]+ 378.17089 189.4
[M+H-H2O]+ 322.20499 180.5
[M+HCOO]- 384.20593 207.5
[M+CH3COO]- 398.22158 228.2
[M+Na-2H]- 360.18240 186.2
[M]+ 339.20718 193.8
[M]- 339.20828 193.8
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.