CID 3056651

Brn 5272684

Structural Information

Molecular Formula
C16H24N2O2
SMILES
C1CN2CCC1C(C2)NCC(COC3=CC=CC=C3)O
InChI
InChI=1S/C16H24N2O2/c19-14(12-20-15-4-2-1-3-5-15)10-17-16-11-18-8-6-13(16)7-9-18/h1-5,13-14,16-17,19H,6-12H2
InChIKey
YWSRPMTTXXPWTC-UHFFFAOYSA-N
Compound name
1-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-phenoxypropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

276.18378 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.19106 160.4
[M+Na]+ 299.17300 169.7
[M+NH4]+ 294.21760 170.1
[M+K]+ 315.14694 162.4
[M-H]- 275.17650 160.3
[M+Na-2H]- 297.15845 160.0
[M]+ 276.18323 161.4
[M]- 276.18433 161.4
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

patents stripe