CID 3060966

78406-73-2

Structural Information

Molecular Formula
C18H31N3O2
SMILES
CCN(CC)CC(C(=O)NC1=CC=CC=C1OC)N(CC)CC
InChI
InChI=1S/C18H31N3O2/c1-6-20(7-2)14-16(21(8-3)9-4)18(22)19-15-12-10-11-13-17(15)23-5/h10-13,16H,6-9,14H2,1-5H3,(H,19,22)
InChIKey
NAOIJRIJQMHTME-UHFFFAOYSA-N
Compound name
2,3-bis(diethylamino)-N-(2-methoxyphenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

321.24164 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.24892 184.0
[M+Na]+ 344.23086 185.8
[M-H]- 320.23436 189.1
[M+NH4]+ 339.27546 198.4
[M+K]+ 360.20480 186.1
[M+H-H2O]+ 304.23890 175.0
[M+HCOO]- 366.23984 208.1
[M+CH3COO]- 380.25549 225.5
[M+Na-2H]- 342.21631 183.4
[M]+ 321.24109 188.5
[M]- 321.24219 188.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.