CID 53216058

1280565-71-0

Structural Information

Molecular Formula
C9H19NO2
SMILES
C[C@@H]1CN(C[C@@H](O1)C)CCCO
InChI
InChI=1S/C9H19NO2/c1-8-6-10(4-3-5-11)7-9(2)12-8/h8-9,11H,3-7H2,1-2H3/t8-,9+
InChIKey
QPWCCVFFSASLDL-DTORHVGOSA-N
Compound name
3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

173.14159 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.148866 140.8
[M+Na]+ 196.130808 146.6
[M-H]- 172.134314 141.7
[M+NH4]+ 191.175413 158.2
[M+K]+ 212.104748 146.4
[M+H-H2O]+ 156.138850 134.7
[M+HCOO]- 218.139791 157.7
[M+CH3COO]- 232.155441 178.7
[M+Na-2H]- 194.116256 145.0
[M]+ 173.14104142 139.4
[M]- 173.14213858 139.4
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