CID 37180

Brn 1137067

Structural Information

Molecular Formula
C17H20N2O2
SMILES
C1CC2=C(C3=CC=CC=C3N2)C(=O)C1CN4CCOCC4
InChI
InChI=1S/C17H20N2O2/c20-17-12(11-19-7-9-21-10-8-19)5-6-15-16(17)13-3-1-2-4-14(13)18-15/h1-4,12,18H,5-11H2
InChIKey
BDAKJRQEUJHFLG-UHFFFAOYSA-N
Compound name
3-(morpholin-4-ylmethyl)-1,2,3,9-tetrahydrocarbazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.15247 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.15975 165.3
[M+Na]+ 307.14169 171.8
[M-H]- 283.14519 169.5
[M+NH4]+ 302.18629 179.8
[M+K]+ 323.11563 166.9
[M+H-H2O]+ 267.14973 156.4
[M+HCOO]- 329.15067 178.6
[M+CH3COO]- 343.16632 175.2
[M+Na-2H]- 305.12714 168.5
[M]+ 284.15192 161.0
[M]- 284.15302 161.0
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