CID 29163

Of 2449

Structural Information

Molecular Formula
C17H22N2O2
SMILES
CN(C)CCN1C2=C(C=C(C=C2)OC)C3=C1C(=O)CCC3
InChI
InChI=1S/C17H22N2O2/c1-18(2)9-10-19-15-8-7-12(21-3)11-14(15)13-5-4-6-16(20)17(13)19/h7-8,11H,4-6,9-10H2,1-3H3
InChIKey
ICDFPRWWFFJQSN-UHFFFAOYSA-N
Compound name
9-[2-(dimethylamino)ethyl]-6-methoxy-3,4-dihydro-2H-carbazol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.16812 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.17540 167.0
[M+Na]+ 309.15734 175.5
[M-H]- 285.16084 172.6
[M+NH4]+ 304.20194 186.2
[M+K]+ 325.13128 172.2
[M+H-H2O]+ 269.16538 159.4
[M+HCOO]- 331.16632 188.5
[M+CH3COO]- 345.18197 209.6
[M+Na-2H]- 307.14279 170.3
[M]+ 286.16757 171.2
[M]- 286.16867 171.2
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.