CID 43102

1-diisopropylaminoacetylindoline

Structural Information

Molecular Formula
C16H24N2O
SMILES
CC(C)N(CC(=O)N1CCC2=CC=CC=C21)C(C)C
InChI
InChI=1S/C16H24N2O/c1-12(2)18(13(3)4)11-16(19)17-10-9-14-7-5-6-8-15(14)17/h5-8,12-13H,9-11H2,1-4H3
InChIKey
GIFYMNNPCUSLAY-UHFFFAOYSA-N
Compound name
1-(2,3-dihydroindol-1-yl)-2-[di(propan-2-yl)amino]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.18887 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.19615 165.8
[M+Na]+ 283.17809 170.1
[M-H]- 259.18159 169.5
[M+NH4]+ 278.22269 184.2
[M+K]+ 299.15203 168.7
[M+H-H2O]+ 243.18613 158.3
[M+HCOO]- 305.18707 184.8
[M+CH3COO]- 319.20272 205.3
[M+Na-2H]- 281.16354 165.2
[M]+ 260.18832 166.4
[M]- 260.18942 166.4
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.