CID 116587485

Rac-(3r,4r)-4-benzoyloxolan-3-amine hydrochloride

Structural Information

Molecular Formula
C11H13NO2
SMILES
C1C(C(CO1)N)C(=O)C2=CC=CC=C2
InChI
InChI=1S/C11H13NO2/c12-10-7-14-6-9(10)11(13)8-4-2-1-3-5-8/h1-5,9-10H,6-7,12H2
InChIKey
NIRDMPWJYQTMJJ-UHFFFAOYSA-N
Compound name
(4-aminooxolan-3-yl)-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.09464 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.10192 142.1
[M+Na]+ 214.08386 152.7
[M+NH4]+ 209.12846 150.5
[M+K]+ 230.05780 149.3
[M-H]- 190.08736 147.0
[M+Na-2H]- 212.06931 148.0
[M]+ 191.09409 144.7
[M]- 191.09519 144.7
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.