CID 10857477

[2-(dimethylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate

Structural Information

Molecular Formula
C12H15NO4
SMILES
CN(C)C(=O)COC(=O)CC1=CC=C(C=C1)O
InChI
InChI=1S/C12H15NO4/c1-13(2)11(15)8-17-12(16)7-9-3-5-10(14)6-4-9/h3-6,14H,7-8H2,1-2H3
InChIKey
QFOYXHSRNCTJOV-UHFFFAOYSA-N
Compound name
[2-(dimethylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

237.10011 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.10739 152.3
[M+Na]+ 260.08933 158.2
[M-H]- 236.09283 155.9
[M+NH4]+ 255.13393 169.5
[M+K]+ 276.06327 158.0
[M+H-H2O]+ 220.09737 145.6
[M+HCOO]- 282.09831 175.2
[M+CH3COO]- 296.11396 194.2
[M+Na-2H]- 258.07478 154.8
[M]+ 237.09956 155.2
[M]- 237.10066 155.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe