CID 28293920

(1r)-6-methoxy-2,3-dihydro-1h-inden-1-ol

Structural Information

Molecular Formula
C10H12O2
SMILES
COC1=CC2=C(CC[C@H]2O)C=C1
InChI
InChI=1S/C10H12O2/c1-12-8-4-2-7-3-5-10(11)9(7)6-8/h2,4,6,10-11H,3,5H2,1H3/t10-/m1/s1
InChIKey
IAVGAIAOOXUVAD-SNVBAGLBSA-N
Compound name
(1R)-6-methoxy-2,3-dihydro-1H-inden-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.08372 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.090996 132.7
[M+Na]+ 187.072938 141.4
[M-H]- 163.076444 136.3
[M+NH4]+ 182.117543 156.0
[M+K]+ 203.046878 139.0
[M+H-H2O]+ 147.080980 128.0
[M+HCOO]- 209.081921 155.1
[M+CH3COO]- 223.097571 175.7
[M+Na-2H]- 185.058386 138.3
[M]+ 164.08317142 132.8
[M]- 164.08426858 132.8
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.