CID 207523

6-ethyl-5,7,12,13-tetrahydro-6h-dibenz(c,g)azonine maleate

Structural Information

Molecular Formula
C18H21N
SMILES
CCN1CC2=CC=CC=C2CCC3=CC=CC=C3C1
InChI
InChI=1S/C18H21N/c1-2-19-13-17-9-5-3-7-15(17)11-12-16-8-4-6-10-18(16)14-19/h3-10H,2,11-14H2,1H3
InChIKey
CUWZVTCKLFWXAO-UHFFFAOYSA-N
Compound name
6-ethyl-5,7,12,13-tetrahydrobenzo[d][2]benzazonine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

0
Patents

251.1674 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.17468 185.1
[M+Na]+ 274.15662 187.4
[M+NH4]+ 269.20122 186.6
[M+K]+ 290.13056 185.0
[M-H]- 250.16012 185.9
[M+Na-2H]- 272.14207 185.2
[M]+ 251.16685 185.8
[M]- 251.16795 185.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.