CID 217796

Brn 0434250

Structural Information

Molecular Formula
C16H24N4O2
SMILES
CN(C)CCCNC(=O)C1CC(=O)N(C1)NC2=CC=CC=C2
InChI
InChI=1S/C16H24N4O2/c1-19(2)10-6-9-17-16(22)13-11-15(21)20(12-13)18-14-7-4-3-5-8-14/h3-5,7-8,13,18H,6,9-12H2,1-2H3,(H,17,22)
InChIKey
CIZFIKDKIMQYCR-UHFFFAOYSA-N
Compound name
1-anilino-N-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.1899 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.197176 172.5
[M+Na]+ 327.179118 175.5
[M-H]- 303.182624 178.5
[M+NH4]+ 322.223723 187.2
[M+K]+ 343.153058 173.5
[M+H-H2O]+ 287.187160 163.1
[M+HCOO]- 349.188101 196.2
[M+CH3COO]- 363.203751 214.7
[M+Na-2H]- 325.164566 173.3
[M]+ 304.18935142 171.3
[M]- 304.19044858 171.3
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.