CID 125514799

2095396-56-6

Structural Information

Molecular Formula
C9H17NO3
SMILES
CC1(OC[C@H](O1)[C@@H]2CNCCO2)C
InChI
InChI=1S/C9H17NO3/c1-9(2)12-6-8(13-9)7-5-10-3-4-11-7/h7-8,10H,3-6H2,1-2H3/t7-,8-/m0/s1
InChIKey
OWGKBHAVTSVSEV-YUMQZZPRSA-N
Compound name
(2S)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.12085 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.12813 141.6
[M+Na]+ 210.11007 151.3
[M+NH4]+ 205.15467 150.6
[M+K]+ 226.08401 147.6
[M-H]- 186.11357 147.0
[M+Na-2H]- 208.09552 145.5
[M]+ 187.12030 144.5
[M]- 187.12140 144.5
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.