CID 3086337

Gea 692

Structural Information

Molecular Formula
C17H28N2O
SMILES
CCN(CC)C(C)C(=O)NC(C)(C)C1=CC=C(C=C1)C
InChI
InChI=1S/C17H28N2O/c1-7-19(8-2)14(4)16(20)18-17(5,6)15-11-9-13(3)10-12-15/h9-12,14H,7-8H2,1-6H3,(H,18,20)
InChIKey
RQWVOCSENLIJHA-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-[2-(4-methylphenyl)propan-2-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.22015 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.227426 170.5
[M+Na]+ 299.209368 174.1
[M-H]- 275.212874 174.9
[M+NH4]+ 294.253973 186.9
[M+K]+ 315.183308 173.1
[M+H-H2O]+ 259.217410 163.4
[M+HCOO]- 321.218351 191.8
[M+CH3COO]- 335.234001 212.4
[M+Na-2H]- 297.194816 171.9
[M]+ 276.21960142 172.4
[M]- 276.22069858 172.4
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.