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]+ 165.09100 132.7
[M+Na]+ 187.07294 141.4
[M-H]- 163.07644 136.3
[M+NH4]+ 182.11754 156.0
[M+K]+ 203.04688 139.0
[M+H-H2O]+ 147.08098 128.0
[M+HCOO]- 209.08192 155.1
[M+CH3COO]- 223.09757 175.7
[M+Na-2H]- 185.05839 138.3
[M]+ 164.08317 132.8
[M]- 164.08427 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.