CID 3086334

Gea 672

Structural Information

Molecular Formula
C16H26N2O
SMILES
CCN(CC)C(C)C(=O)NC(C)(C)C1=CC=CC=C1
InChI
InChI=1S/C16H26N2O/c1-6-18(7-2)13(3)15(19)17-16(4,5)14-11-9-8-10-12-14/h8-13H,6-7H2,1-5H3,(H,17,19)
InChIKey
TWPGFHRFZCQRDJ-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-(2-phenylpropan-2-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.2045 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.21178 166.5
[M+Na]+ 285.19372 169.6
[M-H]- 261.19722 170.6
[M+NH4]+ 280.23832 183.1
[M+K]+ 301.16766 168.7
[M+H-H2O]+ 245.20176 159.3
[M+HCOO]- 307.20270 188.2
[M+CH3COO]- 321.21835 208.2
[M+Na-2H]- 283.17917 169.1
[M]+ 262.20395 167.6
[M]- 262.20505 167.6
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.