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]+ 261.196146 165.8
[M+Na]+ 283.178088 170.1
[M-H]- 259.181594 169.5
[M+NH4]+ 278.222693 184.2
[M+K]+ 299.152028 168.7
[M+H-H2O]+ 243.186130 158.3
[M+HCOO]- 305.187071 184.8
[M+CH3COO]- 319.202721 205.3
[M+Na-2H]- 281.163536 165.2
[M]+ 260.18832142 166.4
[M]- 260.18941858 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.