CID 120264

480-73-9

Structural Information

Molecular Formula
C11H13N
SMILES
C1CC2=C3C(=CC=C2)CCN3C1
InChI
InChI=1S/C11H13N/c1-3-9-5-2-7-12-8-6-10(4-1)11(9)12/h1,3-4H,2,5-8H2
InChIKey
ODRMRGQYRJGWTH-UHFFFAOYSA-N
Compound name
1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

142
Patents

159.1048 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.11208 132.9
[M+Na]+ 182.09402 145.9
[M+NH4]+ 177.13862 144.2
[M+K]+ 198.06796 139.5
[M-H]- 158.09752 135.9
[M+Na-2H]- 180.07947 138.3
[M]+ 159.10425 135.6
[M]- 159.10535 135.6
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