CID 64871

36294-24-3

Structural Information

Molecular Formula
C19H30O3
SMILES
CCOC(=O)CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
InChI
InChI=1S/C19H30O3/c1-8-22-16(20)10-9-13-11-14(18(2,3)4)17(21)15(12-13)19(5,6)7/h11-12,21H,8-10H2,1-7H3
InChIKey
ZCWSUZJGZZFSHM-UHFFFAOYSA-N
Compound name
ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2482
Patents

306.21948 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.22676 177.0
[M+Na]+ 329.20870 187.2
[M+NH4]+ 324.25330 182.7
[M+K]+ 345.18264 182.5
[M-H]- 305.21220 176.4
[M+Na-2H]- 327.19415 180.0
[M]+ 306.21893 178.3
[M]- 306.22003 178.3
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

patents stripe