CID 6914406

3-(2-(n-1-methylethyl-2-propylamino)ethoxyimino)-2,3-dihydro-1h-benz(e)indene hydrochloride

Structural Information

Molecular Formula
C21H28N2O
SMILES
CC(C)N(CCO/N=C\1/CCC2=C1C=CC3=CC=CC=C23)C(C)C
InChI
InChI=1S/C21H28N2O/c1-15(2)23(16(3)4)13-14-24-22-21-12-11-19-18-8-6-5-7-17(18)9-10-20(19)21/h5-10,15-16H,11-14H2,1-4H3/b22-21-
InChIKey
HNXAZSRJFJRAIH-DQRAZIAOSA-N
Compound name
N-[2-[(Z)-1,2-dihydrocyclopenta[a]naphthalen-3-ylideneamino]oxyethyl]-N-propan-2-ylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.22015 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.22743 180.8
[M+Na]+ 347.20937 191.0
[M+NH4]+ 342.25397 189.7
[M+K]+ 363.18331 185.0
[M-H]- 323.21287 185.2
[M+Na-2H]- 345.19482 185.1
[M]+ 324.21960 183.4
[M]- 324.22070 183.4
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.