CID 36912

Y-3310

Structural Information

Molecular Formula
C14H26N2O
SMILES
CC1CC2CN(CC(C1N3CCCC3)C2O)C
InChI
InChI=1S/C14H26N2O/c1-10-7-11-8-15(2)9-12(14(11)17)13(10)16-5-3-4-6-16/h10-14,17H,3-9H2,1-2H3
InChIKey
ITRHAWQMUCWQHM-UHFFFAOYSA-N
Compound name
3,7-dimethyl-6-pyrrolidin-1-yl-3-azabicyclo[3.3.1]nonan-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.20451 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.21179 161.1
[M+Na]+ 261.19373 165.4
[M-H]- 237.19723 161.8
[M+NH4]+ 256.23833 178.9
[M+K]+ 277.16767 161.6
[M+H-H2O]+ 221.20177 153.6
[M+HCOO]- 283.20271 171.6
[M+CH3COO]- 297.21836 170.3
[M+Na-2H]- 259.17918 159.8
[M]+ 238.20396 153.7
[M]- 238.20506 153.7
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.