CID 38188

Brn 0424340

Structural Information

Molecular Formula
C20H26N2O
SMILES
CC1CCCN(C1)CC2CCC3=C(C2=O)C4=CC=CC=C4N3C
InChI
InChI=1S/C20H26N2O/c1-14-6-5-11-22(12-14)13-15-9-10-18-19(20(15)23)16-7-3-4-8-17(16)21(18)2/h3-4,7-8,14-15H,5-6,9-13H2,1-2H3
InChIKey
RENHZRCBGFCRPI-UHFFFAOYSA-N
Compound name
9-methyl-3-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.2045 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.21178 177.4
[M+Na]+ 333.19372 184.6
[M-H]- 309.19722 182.4
[M+NH4]+ 328.23832 193.4
[M+K]+ 349.16766 178.2
[M+H-H2O]+ 293.20176 167.9
[M+HCOO]- 355.20270 191.7
[M+CH3COO]- 369.21835 187.2
[M+Na-2H]- 331.17917 177.2
[M]+ 310.20395 174.4
[M]- 310.20505 174.4
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

patents stripe