CID 203101

13887-57-5

Structural Information

Molecular Formula
C15H21NO5
SMILES
CC(C)CNC(=O)OCC(C1COC2=CC=CC=C2O1)O
InChI
InChI=1S/C15H21NO5/c1-10(2)7-16-15(18)20-8-11(17)14-9-19-12-5-3-4-6-13(12)21-14/h3-6,10-11,14,17H,7-9H2,1-2H3,(H,16,18)
InChIKey
LMWSHNLEYBZEOC-UHFFFAOYSA-N
Compound name
[2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl] N-(2-methylpropyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.14197 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.14925 169.0
[M+Na]+ 318.13119 177.7
[M+NH4]+ 313.17579 174.7
[M+K]+ 334.10513 174.5
[M-H]- 294.13469 171.9
[M+Na-2H]- 316.11664 170.2
[M]+ 295.14142 170.6
[M]- 295.14252 170.6
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.