CID 5463809

92836-10-7

Structural Information

Molecular Formula
C18H26O
SMILES
CC1=CC2=C(C=C1C(=O)C)C(CC2(C)C(C)C)(C)C
InChI
InChI=1S/C18H26O/c1-11(2)18(7)10-17(5,6)15-9-14(13(4)19)12(3)8-16(15)18/h8-9,11H,10H2,1-7H3
InChIKey
HADLISHZBKJUMM-UHFFFAOYSA-N
Compound name
1-(1,3,3,6-tetramethyl-1-propan-2-yl-2H-inden-5-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

258.19836 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.20564 159.0
[M+Na]+ 281.18758 168.4
[M-H]- 257.19108 164.3
[M+NH4]+ 276.23218 183.8
[M+K]+ 297.16152 165.0
[M+H-H2O]+ 241.19562 155.4
[M+HCOO]- 303.19656 178.2
[M+CH3COO]- 317.21221 202.9
[M+Na-2H]- 279.17303 159.9
[M]+ 258.19781 161.9
[M]- 258.19891 161.9
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