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-[(2R,6S)-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]+ 174.14887 140.8
[M+Na]+ 196.13081 146.6
[M-H]- 172.13431 141.7
[M+NH4]+ 191.17541 158.2
[M+K]+ 212.10475 146.4
[M+H-H2O]+ 156.13885 134.7
[M+HCOO]- 218.13979 157.7
[M+CH3COO]- 232.15544 178.7
[M+Na-2H]- 194.11626 145.0
[M]+ 173.14104 139.4
[M]- 173.14214 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