CID 3060525

C 6578

Structural Information

Molecular Formula
C16H26N2O2
SMILES
CCN(CC)CCC(=O)N(C)CCOC1=CC=CC=C1
InChI
InChI=1S/C16H26N2O2/c1-4-18(5-2)12-11-16(19)17(3)13-14-20-15-9-7-6-8-10-15/h6-10H,4-5,11-14H2,1-3H3
InChIKey
RBNOTYIWUKGKJQ-UHFFFAOYSA-N
Compound name
3-(diethylamino)-N-methyl-N-(2-phenoxyethyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.19943 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.20671 170.8
[M+Na]+ 301.18865 173.7
[M-H]- 277.19215 175.9
[M+NH4]+ 296.23325 187.2
[M+K]+ 317.16259 173.7
[M+H-H2O]+ 261.19669 162.2
[M+HCOO]- 323.19763 195.6
[M+CH3COO]- 337.21328 212.5
[M+Na-2H]- 299.17410 172.9
[M]+ 278.19888 175.6
[M]- 278.19998 175.6
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.