CID 38186

Brn 4303750

Structural Information

Molecular Formula
C18H22N2O2
SMILES
CN1C2=C(C3=CC=CC=C31)C(=O)C(CC2)CN4CCOCC4
InChI
InChI=1S/C18H22N2O2/c1-19-15-5-3-2-4-14(15)17-16(19)7-6-13(18(17)21)12-20-8-10-22-11-9-20/h2-5,13H,6-12H2,1H3
InChIKey
YDWKRSVMKLPHPX-UHFFFAOYSA-N
Compound name
9-methyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.16812 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.17540 170.7
[M+Na]+ 321.15734 178.0
[M-H]- 297.16084 176.4
[M+NH4]+ 316.20194 185.6
[M+K]+ 337.13128 173.7
[M+H-H2O]+ 281.16538 161.4
[M+HCOO]- 343.16632 185.1
[M+CH3COO]- 357.18197 181.1
[M+Na-2H]- 319.14279 172.9
[M]+ 298.16757 168.8
[M]- 298.16867 168.8
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.