CID 14499117

93799-17-8

Structural Information

Molecular Formula
C22H32N4O2
SMILES
CCC1=NC2=CC=CC=C2C(=O)N1CCCNC(=O)C3CC(NC3(C)C)(C)C
InChI
InChI=1S/C22H32N4O2/c1-6-18-24-17-11-8-7-10-15(17)20(28)26(18)13-9-12-23-19(27)16-14-21(2,3)25-22(16,4)5/h7-8,10-11,16,25H,6,9,12-14H2,1-5H3,(H,23,27)
InChIKey
IDZZJRYGIJSJJH-UHFFFAOYSA-N
Compound name
N-[3-(2-ethyl-4-oxoquinazolin-3-yl)propyl]-2,2,5,5-tetramethylpyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

384.25253 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.25981 194.0
[M+Na]+ 407.24175 201.9
[M-H]- 383.24525 196.5
[M+NH4]+ 402.28635 208.1
[M+K]+ 423.21569 195.9
[M+H-H2O]+ 367.24979 185.3
[M+HCOO]- 429.25073 208.8
[M+CH3COO]- 443.26638 222.6
[M+Na-2H]- 405.22720 194.5
[M]+ 384.25198 195.2
[M]- 384.25308 195.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.