CID 37431

36396-01-7

Structural Information

Molecular Formula
C23H28N2O3
SMILES
CC1(C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3)OCCCN4CCOCC4
InChI
InChI=1S/C23H28N2O3/c1-23(28-15-7-12-24-13-16-27-17-14-24)20-10-5-6-11-21(20)25(22(23)26)18-19-8-3-2-4-9-19/h2-6,8-11H,7,12-18H2,1H3
InChIKey
DJLQHIXQQBFDNR-UHFFFAOYSA-N
Compound name
1-benzyl-3-methyl-3-(3-morpholin-4-ylpropoxy)indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.21 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.217276 193.8
[M+Na]+ 403.199218 198.7
[M-H]- 379.202724 200.9
[M+NH4]+ 398.243823 205.4
[M+K]+ 419.173158 194.5
[M+H-H2O]+ 363.207260 182.6
[M+HCOO]- 425.208201 208.2
[M+CH3COO]- 439.223851 202.2
[M+Na-2H]- 401.184666 194.6
[M]+ 380.20945142 193.4
[M]- 380.21054858 193.4
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.