CID 165739371

(7-chloro-2,3-dihydro-1h-inden-4-yl)methanol

Structural Information

Molecular Formula
C10H11ClO
SMILES
C1CC2=C(C=CC(=C2C1)Cl)CO
InChI
InChI=1S/C10H11ClO/c11-10-5-4-7(6-12)8-2-1-3-9(8)10/h4-5,12H,1-3,6H2
InChIKey
BUGSVTAEDOIRKR-UHFFFAOYSA-N
Compound name
(7-chloro-2,3-dihydro-1H-inden-4-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.04984 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.05712 137.1
[M+Na]+ 205.03906 146.8
[M-H]- 181.04256 140.5
[M+NH4]+ 200.08366 160.6
[M+K]+ 221.01300 141.8
[M+H-H2O]+ 165.04710 133.2
[M+HCOO]- 227.04804 154.7
[M+CH3COO]- 241.06369 177.6
[M+Na-2H]- 203.02451 142.1
[M]+ 182.04929 137.8
[M]- 182.05039 137.8
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.