CID 203103

13887-59-7

Structural Information

Molecular Formula
C14H19NO5
SMILES
CC(C)NC(=O)OCC(C1COC2=CC=CC=C2O1)O
InChI
InChI=1S/C14H19NO5/c1-9(2)15-14(17)19-7-10(16)13-8-18-11-5-3-4-6-12(11)20-13/h3-6,9-10,13,16H,7-8H2,1-2H3,(H,15,17)
InChIKey
HHPCQLLZYJQHJX-UHFFFAOYSA-N
Compound name
[2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl] N-propan-2-ylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.1263 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.133576 165.1
[M+Na]+ 304.115518 168.7
[M-H]- 280.119024 168.6
[M+NH4]+ 299.160123 177.9
[M+K]+ 320.089458 170.0
[M+H-H2O]+ 264.123560 158.0
[M+HCOO]- 326.124501 180.8
[M+CH3COO]- 340.140151 199.7
[M+Na-2H]- 302.100966 169.3
[M]+ 281.12575142 166.3
[M]- 281.12684858 166.3
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.