CID 27608

Of 2444

Structural Information

Molecular Formula
C16H20N2O
SMILES
CN(C)CCN1C2=CC=CC=C2C3=C1C(=O)CCC3
InChI
InChI=1S/C16H20N2O/c1-17(2)10-11-18-14-8-4-3-6-12(14)13-7-5-9-15(19)16(13)18/h3-4,6,8H,5,7,9-11H2,1-2H3
InChIKey
DIEBGCISQXKRQE-UHFFFAOYSA-N
Compound name
9-[2-(dimethylamino)ethyl]-3,4-dihydro-2H-carbazol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.15756 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.16484 159.2
[M+Na]+ 279.14678 167.4
[M-H]- 255.15028 164.6
[M+NH4]+ 274.19138 179.4
[M+K]+ 295.12072 163.6
[M+H-H2O]+ 239.15482 151.6
[M+HCOO]- 301.15576 180.9
[M+CH3COO]- 315.17141 203.3
[M+Na-2H]- 277.13223 163.6
[M]+ 256.15701 161.2
[M]- 256.15811 161.2
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.