CID 24845730

102280-97-7

Structural Information

Molecular Formula
C11H14N2
SMILES
C1CC2=C3C(=CC(=C2)N)CCN3C1
InChI
InChI=1S/C11H14N2/c12-10-6-8-2-1-4-13-5-3-9(7-10)11(8)13/h6-7H,1-5,12H2
InChIKey
HXLIXTQXRDVYHV-UHFFFAOYSA-N
Compound name
1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.11569 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.122966 136.4
[M+Na]+ 197.104908 143.7
[M-H]- 173.108414 139.0
[M+NH4]+ 192.149513 159.1
[M+K]+ 213.078848 140.0
[M+H-H2O]+ 157.112950 130.0
[M+HCOO]- 219.113891 155.7
[M+CH3COO]- 233.129541 149.1
[M+Na-2H]- 195.090356 142.6
[M]+ 174.11514142 132.5
[M]- 174.11623858 132.5
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.