CID 205275

4a,8a-(methaniminomethano)naphthalene, 1,4,5,8-tetrahydro-10-methyl-, hydrochloride

Structural Information

Molecular Formula
C13H19N
SMILES
CN1CC23CC=CCC2(C1)CC=CC3
InChI
InChI=1S/C13H19N/c1-14-10-12-6-2-3-7-13(12,11-14)9-5-4-8-12/h2-5H,6-11H2,1H3
InChIKey
LWWJEUDYPMYYSW-UHFFFAOYSA-N
Compound name
12-methyl-12-azatricyclo[4.4.3.01,6]trideca-3,8-diene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.15175 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 146.1
[M+Na]+ 212.14097 157.8
[M+NH4]+ 207.18557 159.6
[M+K]+ 228.11491 147.7
[M-H]- 188.14447 150.2
[M+Na-2H]- 210.12642 155.0
[M]+ 189.15120 149.3
[M]- 189.15230 149.3
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.