CID 6914405

1,2-dihydro-3h-benz(e)inden-3-one o-(2-(diethylamino)ethyl)oxime monohydrochloride

Structural Information

Molecular Formula
C19H24N2O
SMILES
CCN(CC)CCO/N=C\1/CCC2=C1C=CC3=CC=CC=C23
InChI
InChI=1S/C19H24N2O/c1-3-21(4-2)13-14-22-20-19-12-11-17-16-8-6-5-7-15(16)9-10-18(17)19/h5-10H,3-4,11-14H2,1-2H3/b20-19-
InChIKey
CRFXJZGPVZPKJN-VXPUYCOJSA-N
Compound name
2-[(Z)-1,2-dihydrocyclopenta[a]naphthalen-3-ylideneamino]oxy-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

296.18887 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.19615 171.3
[M+Na]+ 319.17809 176.8
[M-H]- 295.18159 178.4
[M+NH4]+ 314.22269 191.2
[M+K]+ 335.15203 173.4
[M+H-H2O]+ 279.18613 163.2
[M+HCOO]- 341.18707 195.8
[M+CH3COO]- 355.20272 215.2
[M+Na-2H]- 317.16354 175.8
[M]+ 296.18832 174.5
[M]- 296.18942 174.5
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

patents stripe