CID 103763

2h-1-benzopyran-6-ol, 3,4-dihydro-2-methoxy-2,5,7,8-tetramethyl-

Structural Information

Molecular Formula
C14H20O3
SMILES
CC1=C(C2=C(CCC(O2)(C)OC)C(=C1O)C)C
InChI
InChI=1S/C14H20O3/c1-8-9(2)13-11(10(3)12(8)15)6-7-14(4,16-5)17-13/h15H,6-7H2,1-5H3
InChIKey
KCTHYRRQQNMFKC-UHFFFAOYSA-N
Compound name
2-methoxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

236.14125 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.14853 151.4
[M+Na]+ 259.13047 161.3
[M-H]- 235.13397 156.2
[M+NH4]+ 254.17507 171.6
[M+K]+ 275.10441 160.0
[M+H-H2O]+ 219.13851 146.6
[M+HCOO]- 281.13945 169.5
[M+CH3COO]- 295.15510 193.6
[M+Na-2H]- 257.11592 156.7
[M]+ 236.14070 154.6
[M]- 236.14180 154.6
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