CID 1897040

103595-81-9

Structural Information

Molecular Formula
C32H48N2O2
SMILES
CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C=NCCN=CC2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)O
InChI
InChI=1S/C32H48N2O2/c1-29(2,3)23-15-21(27(35)25(17-23)31(7,8)9)19-33-13-14-34-20-22-16-24(30(4,5)6)18-26(28(22)36)32(10,11)12/h15-20,35-36H,13-14H2,1-12H3
InChIKey
SSYLTCZZAVKLCT-UHFFFAOYSA-N
Compound name
2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

46
Patents

492.37158 Da
Monoisotopic Mass

8.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 493.37886 227.1
[M+Na]+ 515.36080 231.7
[M-H]- 491.36430 233.6
[M+NH4]+ 510.40540 235.5
[M+K]+ 531.33474 227.5
[M+H-H2O]+ 475.36884 219.4
[M+HCOO]- 537.36978 241.6
[M+CH3COO]- 551.38543 253.2
[M+Na-2H]- 513.34625 227.5
[M]+ 492.37103 232.3
[M]- 492.37213 232.3
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.