CID 3077811

Brn 5349668

Structural Information

Molecular Formula
C19H22N2O
SMILES
CCOC=NC1=C(C2(CCCCC2)CC3=CC=CC=C31)C#N
InChI
InChI=1S/C19H22N2O/c1-2-22-14-21-18-16-9-5-4-8-15(16)12-19(17(18)13-20)10-6-3-7-11-19/h4-5,8-9,14H,2-3,6-7,10-12H2,1H3
InChIKey
IGMHKMWRLGLCGX-UHFFFAOYSA-N
Compound name
ethyl N-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)methanimidate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.17322 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.18050 175.8
[M+Na]+ 317.16244 187.7
[M+NH4]+ 312.20704 182.8
[M+K]+ 333.13638 173.6
[M-H]- 293.16594 173.4
[M+Na-2H]- 315.14789 180.4
[M]+ 294.17267 176.2
[M]- 294.17377 176.2
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.