CID 3086789

Brn 5541113

Structural Information

Molecular Formula
C15H22N2O
SMILES
CN(C)C(C(C=C)C1=CC=CC=C1)C(=O)N(C)C
InChI
InChI=1S/C15H22N2O/c1-6-13(12-10-8-7-9-11-12)14(16(2)3)15(18)17(4)5/h6-11,13-14H,1H2,2-5H3
InChIKey
ZBHIIIVFQJPKHJ-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-N,N-dimethyl-3-phenylpent-4-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.17322 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.18050 161.6
[M+Na]+ 269.16244 164.9
[M-H]- 245.16594 167.3
[M+NH4]+ 264.20704 179.2
[M+K]+ 285.13638 165.1
[M+H-H2O]+ 229.17048 154.0
[M+HCOO]- 291.17142 184.9
[M+CH3COO]- 305.18707 208.4
[M+Na-2H]- 267.14789 162.0
[M]+ 246.17267 162.8
[M]- 246.17377 162.8
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.