CID 18390

Brn 2812448

Structural Information

Molecular Formula
C16H27N3O
SMILES
CN(C)CCC(CCN(C)C)(C1=CC=CC=C1)C(=O)N
InChI
InChI=1S/C16H27N3O/c1-18(2)12-10-16(15(17)20,11-13-19(3)4)14-8-6-5-7-9-14/h5-9H,10-13H2,1-4H3,(H2,17,20)
InChIKey
GAMSVHKCGRVPPR-UHFFFAOYSA-N
Compound name
4-(dimethylamino)-2-[2-(dimethylamino)ethyl]-2-phenylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.21542 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.222696 170.5
[M+Na]+ 300.204638 173.0
[M-H]- 276.208144 175.3
[M+NH4]+ 295.249243 186.4
[M+K]+ 316.178578 172.7
[M+H-H2O]+ 260.212680 162.4
[M+HCOO]- 322.213621 193.9
[M+CH3COO]- 336.229271 215.9
[M+Na-2H]- 298.190086 172.7
[M]+ 277.21487142 171.7
[M]- 277.21596858 171.7
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

No patent data available for this compound.