CID 32952

5h-dibenzo(a,d)cyclohepten-5-one, o-(2-(dimethylamino)propyl)oxime, monohydrochloride

Structural Information

Molecular Formula
C20H22N2O
SMILES
CC(CON=C1C2=CC=CC=C2C=CC3=CC=CC=C31)N(C)C
InChI
InChI=1S/C20H22N2O/c1-15(22(2)3)14-23-21-20-18-10-6-4-8-16(18)12-13-17-9-5-7-11-19(17)20/h4-13,15H,14H2,1-3H3
InChIKey
OUHIJNOMRMDKPS-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylideneamino)oxypropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.17322 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.18050 171.4
[M+Na]+ 329.16244 183.7
[M+NH4]+ 324.20704 180.0
[M+K]+ 345.13638 176.4
[M-H]- 305.16594 176.7
[M+Na-2H]- 327.14789 179.3
[M]+ 306.17267 174.9
[M]- 306.17377 174.9
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.