CID 381975

65746-64-7

Structural Information

Molecular Formula
C20H20N2O
SMILES
C1CCN(C1)C(=O)CN2C3=CC=CC=C3C=C2C4=CC=CC=C4
InChI
InChI=1S/C20H20N2O/c23-20(21-12-6-7-13-21)15-22-18-11-5-4-10-17(18)14-19(22)16-8-2-1-3-9-16/h1-5,8-11,14H,6-7,12-13,15H2
InChIKey
XQQKZHKJJACIRO-UHFFFAOYSA-N
Compound name
2-(2-phenylindol-1-yl)-1-pyrrolidin-1-ylethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

304.15756 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.16484 172.7
[M+Na]+ 327.14678 179.9
[M-H]- 303.15028 180.9
[M+NH4]+ 322.19138 189.0
[M+K]+ 343.12072 174.2
[M+H-H2O]+ 287.15482 163.3
[M+HCOO]- 349.15576 193.1
[M+CH3COO]- 363.17141 183.8
[M+Na-2H]- 325.13223 173.2
[M]+ 304.15701 172.0
[M]- 304.15811 172.0
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