CID 53338732

(2r,3r)-2-methyl-3-morpholinemethanol

Structural Information

Molecular Formula
C6H13NO2
SMILES
C[C@@H]1[C@H](NCCO1)CO
InChI
InChI=1S/C6H13NO2/c1-5-6(4-8)7-2-3-9-5/h5-8H,2-4H2,1H3/t5-,6-/m1/s1
InChIKey
PWDXWDJQJUXDSL-PHDIDXHHSA-N
Compound name
[(2R,3R)-2-methylmorpholin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

131.09464 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 128.2
[M+Na]+ 154.08386 133.9
[M-H]- 130.08736 127.8
[M+NH4]+ 149.12846 146.2
[M+K]+ 170.05780 133.4
[M+H-H2O]+ 114.09190 122.5
[M+HCOO]- 176.09284 144.6
[M+CH3COO]- 190.10849 165.8
[M+Na-2H]- 152.06931 134.2
[M]+ 131.09409 123.3
[M]- 131.09519 123.3
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