CID 96637659

1657033-35-6

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

131.09464 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.101916 126.6
[M+Na]+ 154.083858 132.2
[M-H]- 130.087364 130.0
[M+NH4]+ 149.128463 146.7
[M+K]+ 170.057798 133.2
[M+H-H2O]+ 114.091900 121.1
[M+HCOO]- 176.092841 147.7
[M+CH3COO]- 190.108491 172.6
[M+Na-2H]- 152.069306 132.9
[M]+ 131.09409142 123.2
[M]- 131.09518858 123.2
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