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]+ 146.117556 131.8
[M+Na]+ 168.099498 137.6
[M-H]- 144.103004 135.7
[M+NH4]+ 163.144103 153.4
[M+K]+ 184.073438 139.0
[M+H-H2O]+ 128.107540 126.5
[M+HCOO]- 190.108481 154.2
[M+CH3COO]- 204.124131 176.9
[M+Na-2H]- 166.084946 136.1
[M]+ 145.10973142 131.1
[M]- 145.11082858 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.