CID 3010146

Schembl13766183

Structural Information

Molecular Formula
C13H23N
SMILES
CN(C)C12CCC3CC(C1)CC(C3)C2
InChI
InChI=1S/C13H23N/c1-14(2)13-4-3-10-5-11(8-13)7-12(6-10)9-13/h10-12H,3-9H2,1-2H3
InChIKey
SLXMKWMDEYNTAL-UHFFFAOYSA-N
Compound name
N,N-dimethyltricyclo[4.3.1.13,8]undecan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

193.18304 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.190316 155.9
[M+Na]+ 216.172258 162.2
[M-H]- 192.175764 157.7
[M+NH4]+ 211.216863 179.4
[M+K]+ 232.146198 156.8
[M+H-H2O]+ 176.180300 156.5
[M+HCOO]- 238.181241 165.2
[M+CH3COO]- 252.196891 164.9
[M+Na-2H]- 214.157706 165.0
[M]+ 193.18249142 154.0
[M]- 193.18358858 154.0
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