CID 146155290

Rac-(3r,4r)-4-[(dimethylamino)methyl]oxolan-3-ol

Structural Information

Molecular Formula
C7H15NO2
SMILES
CN(C)C[C@@H]1COC[C@@H]1O
InChI
InChI=1S/C7H15NO2/c1-8(2)3-6-4-10-5-7(6)9/h6-7,9H,3-5H2,1-2H3/t6-,7+/m1/s1
InChIKey
ZKYKUWFATZYRGF-RQJHMYQMSA-N
Compound name
(3R,4R)-4-[(dimethylamino)methyl]oxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.11028 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.11756 131.8
[M+Na]+ 168.09950 137.6
[M-H]- 144.10300 135.7
[M+NH4]+ 163.14410 153.4
[M+K]+ 184.07344 139.0
[M+H-H2O]+ 128.10754 126.5
[M+HCOO]- 190.10848 154.2
[M+CH3COO]- 204.12413 176.9
[M+Na-2H]- 166.08495 136.1
[M]+ 145.10973 131.1
[M]- 145.11083 131.1
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.