CID 22819

1-indanol

Structural Information

Molecular Formula
C9H10O
SMILES
C1CC2=CC=CC=C2C1O
InChI
InChI=1S/C9H10O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9-10H,5-6H2
InChIKey
YIAPLDFPUUJILH-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-inden-1-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

38
References

4936
Patents

134.07317 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.08045 125.2
[M+Na]+ 157.06239 133.6
[M-H]- 133.06589 128.6
[M+NH4]+ 152.10699 149.5
[M+K]+ 173.03633 130.8
[M+H-H2O]+ 117.07043 120.6
[M+HCOO]- 179.07137 147.8
[M+CH3COO]- 193.08702 169.6
[M+Na-2H]- 155.04784 132.1
[M]+ 134.07262 123.2
[M]- 134.07372 123.2
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.