CID 6914405

3h-benz(e)inden-3-one, 1,2-dihydro-, 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

0
Patents

296.18887 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.196146 171.3
[M+Na]+ 319.178088 176.8
[M-H]- 295.181594 178.4
[M+NH4]+ 314.222693 191.2
[M+K]+ 335.152028 173.4
[M+H-H2O]+ 279.186130 163.2
[M+HCOO]- 341.187071 195.8
[M+CH3COO]- 355.202721 215.2
[M+Na-2H]- 317.163536 175.8
[M]+ 296.18832142 174.5
[M]- 296.18941858 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