CID 6914404

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

Structural Information

Molecular Formula
C17H20N2O
SMILES
CN(C)CCO/N=C\1/CCC2=C1C=CC3=CC=CC=C23
InChI
InChI=1S/C17H20N2O/c1-19(2)11-12-20-18-17-10-9-15-14-6-4-3-5-13(14)7-8-16(15)17/h3-8H,9-12H2,1-2H3/b18-17-
InChIKey
NOWBTTYMUYWJNX-ZCXUNETKSA-N
Compound name
2-[(Z)-1,2-dihydrocyclopenta[a]naphthalen-3-ylideneamino]oxy-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.15756 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.16484 161.8
[M+Na]+ 291.14678 168.3
[M-H]- 267.15028 169.4
[M+NH4]+ 286.19138 182.9
[M+K]+ 307.12072 165.3
[M+H-H2O]+ 251.15482 154.2
[M+HCOO]- 313.15576 187.1
[M+CH3COO]- 327.17141 209.2
[M+Na-2H]- 289.13223 167.5
[M]+ 268.15701 164.4
[M]- 268.15811 164.4
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.