CID 135472366

3,5-di-t-butyl-4-hydroxybenzaldoxime

Structural Information

Molecular Formula
C15H23NO2
SMILES
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=N/O
InChI
InChI=1S/C15H23NO2/c1-14(2,3)11-7-10(9-16-18)8-12(13(11)17)15(4,5)6/h7-9,17-18H,1-6H3/b16-9+
InChIKey
MHAZQZQNQAMVMT-CXUHLZMHSA-N
Compound name
2,6-ditert-butyl-4-[(E)-hydroxyiminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

16
Patents

249.17288 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.18016 159.7
[M+Na]+ 272.16210 167.4
[M-H]- 248.16560 162.7
[M+NH4]+ 267.20670 177.3
[M+K]+ 288.13604 164.8
[M+H-H2O]+ 232.17014 154.8
[M+HCOO]- 294.17108 179.4
[M+CH3COO]- 308.18673 197.3
[M+Na-2H]- 270.14755 164.3
[M]+ 249.17233 161.4
[M]- 249.17343 161.4
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