CID 103629

52378-03-7

Structural Information

Molecular Formula
C19H21NO2
SMILES
CNCC1COC2(O1)C3=CC=CC=C3CCC4=CC=CC=C24
InChI
InChI=1S/C19H21NO2/c1-20-12-16-13-21-19(22-16)17-8-4-2-6-14(17)10-11-15-7-3-5-9-18(15)19/h2-9,16,20H,10-13H2,1H3
InChIKey
UTGOFPKDKSCNFW-UHFFFAOYSA-N
Compound name
N-methyl-1-spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-4-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.15723 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.16451 172.4
[M+Na]+ 318.14645 183.5
[M+NH4]+ 313.19105 182.6
[M+K]+ 334.12039 176.9
[M-H]- 294.14995 179.5
[M+Na-2H]- 316.13190 178.1
[M]+ 295.15668 176.3
[M]- 295.15778 176.3
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.