CID 47086

Carbonic acid, ethyl (m-dimethylamino)phenyl ester, hydrochloride

Structural Information

Molecular Formula
C11H15NO3
SMILES
CCOC(=O)OC1=CC=CC(=C1)N(C)C
InChI
InChI=1S/C11H15NO3/c1-4-14-11(13)15-10-7-5-6-9(8-10)12(2)3/h5-8H,4H2,1-3H3
InChIKey
JMKIGURTPAFOAN-UHFFFAOYSA-N
Compound name
[3-(dimethylamino)phenyl] ethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.1052 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.112476 145.5
[M+Na]+ 232.094418 152.4
[M-H]- 208.097924 150.7
[M+NH4]+ 227.139023 165.0
[M+K]+ 248.068358 152.9
[M+H-H2O]+ 192.102460 138.9
[M+HCOO]- 254.103401 170.9
[M+CH3COO]- 268.119051 191.6
[M+Na-2H]- 230.079866 150.3
[M]+ 209.10465142 149.9
[M]- 209.10574858 149.9
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.