CID 15929269

86646-86-8

Structural Information

Molecular Formula
C12H16O2
SMILES
CC1CC2=C(O1)C(=C(C(=C2C)O)C)C
InChI
InChI=1S/C12H16O2/c1-6-5-10-9(4)11(13)7(2)8(3)12(10)14-6/h6,13H,5H2,1-4H3
InChIKey
GPPLHUABFZEVNF-UHFFFAOYSA-N
Compound name
2,4,6,7-tetramethyl-2,3-dihydro-1-benzofuran-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

192.11504 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.122316 140.6
[M+Na]+ 215.104258 151.4
[M-H]- 191.107764 145.7
[M+NH4]+ 210.148863 162.5
[M+K]+ 231.078198 149.4
[M+H-H2O]+ 175.112300 136.7
[M+HCOO]- 237.113241 161.4
[M+CH3COO]- 251.128891 185.4
[M+Na-2H]- 213.089706 144.2
[M]+ 192.11449142 143.3
[M]- 192.11558858 143.3
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