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]+ 257.164836 159.2
[M+Na]+ 279.146778 167.4
[M-H]- 255.150284 164.6
[M+NH4]+ 274.191383 179.4
[M+K]+ 295.120718 163.6
[M+H-H2O]+ 239.154820 151.6
[M+HCOO]- 301.155761 180.9
[M+CH3COO]- 315.171411 203.3
[M+Na-2H]- 277.132226 163.6
[M]+ 256.15701142 161.2
[M]- 256.15810858 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.