CID 3049470

64838-02-4

Structural Information

Molecular Formula
C14H19N
SMILES
CN1C2CCC1CC(C2)C3=CC=CC=C3
InChI
InChI=1S/C14H19N/c1-15-13-7-8-14(15)10-12(9-13)11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3
InChIKey
VGZDEVKDDGMADS-UHFFFAOYSA-N
Compound name
8-methyl-3-phenyl-8-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

21
References

310
Patents

201.15175 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.15903 147.0
[M+Na]+ 224.14097 159.8
[M+NH4]+ 219.18557 157.8
[M+K]+ 240.11491 153.1
[M-H]- 200.14447 151.1
[M+Na-2H]- 222.12642 152.7
[M]+ 201.15120 150.0
[M]- 201.15230 150.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe