CID 2302250

128099-74-1

Structural Information

Molecular Formula
C19H18N2O2
SMILES
C1CN(C2=CC=CC=C21)C(=O)CC(=O)N3CCC4=CC=CC=C43
InChI
InChI=1S/C19H18N2O2/c22-18(20-11-9-14-5-1-3-7-16(14)20)13-19(23)21-12-10-15-6-2-4-8-17(15)21/h1-8H,9-13H2
InChIKey
PHEUSRFARQHWGC-UHFFFAOYSA-N
Compound name
1,3-bis(2,3-dihydroindol-1-yl)propane-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

306.13684 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.14412 172.4
[M+Na]+ 329.12606 184.1
[M+NH4]+ 324.17066 180.5
[M+K]+ 345.10000 180.8
[M-H]- 305.12956 175.1
[M+Na-2H]- 327.11151 177.0
[M]+ 306.13629 174.6
[M]- 306.13739 174.6
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

patents stripe