CID 50936913

Hvtgpxynydwjhk-gxsjlcmtsa-

Structural Information

Molecular Formula
C11H14O2
SMILES
C[C@H]1CO[C@H](O1)CC2=CC=CC=C2
InChI
InChI=1S/C11H14O2/c1-9-8-12-11(13-9)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3/t9-,11+/m0/s1
InChIKey
HVTGPXYNYDWJHK-GXSJLCMTSA-N
Compound name
(2R,4S)-2-benzyl-4-methyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

178.09938 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.10666 137.4
[M+Na]+ 201.08860 150.4
[M+NH4]+ 196.13320 146.8
[M+K]+ 217.06254 145.9
[M-H]- 177.09210 144.0
[M+Na-2H]- 199.07405 144.2
[M]+ 178.09883 141.2
[M]- 178.09993 141.2
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

No patent data available for this compound.