CID 15724700

135452-43-6

Structural Information

Molecular Formula
C26H32O4
SMILES
CC1(CC(C2=C1C=C(C=C2)C(=O)C(C)(C)O)(C)C3=CC=C(C=C3)C(=O)C(C)(C)O)C
InChI
InChI=1S/C26H32O4/c1-23(2)15-26(7,18-11-8-16(9-12-18)21(27)24(3,4)29)19-13-10-17(14-20(19)23)22(28)25(5,6)30/h8-14,29-30H,15H2,1-7H3
InChIKey
MRBZZNMTRWISRD-UHFFFAOYSA-N
Compound name
2-hydroxy-1-[4-[5-(2-hydroxy-2-methylpropanoyl)-1,3,3-trimethyl-2H-inden-1-yl]phenyl]-2-methylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

708
Patents

408.23007 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.23735 198.4
[M+Na]+ 431.21929 205.1
[M-H]- 407.22279 203.6
[M+NH4]+ 426.26389 214.9
[M+K]+ 447.19323 201.2
[M+H-H2O]+ 391.22733 194.2
[M+HCOO]- 453.22827 210.7
[M+CH3COO]- 467.24392 223.9
[M+Na-2H]- 429.20474 199.8
[M]+ 408.22952 200.9
[M]- 408.23062 200.9
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

patents stripe