CID 253824

104176-99-0

Structural Information

Molecular Formula
C11H18O2
SMILES
C1C(CC2C1C3CC2C(C3)O)CO
InChI
InChI=1S/C11H18O2/c12-5-6-1-8-7-3-10(9(8)2-6)11(13)4-7/h6-13H,1-5H2
InChIKey
OLTXWMMREJPHOR-UHFFFAOYSA-N
Compound name
4-(hydroxymethyl)tricyclo[5.2.1.02,6]decan-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

182.13068 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.137956 144.7
[M+Na]+ 205.119898 151.7
[M-H]- 181.123404 146.1
[M+NH4]+ 200.164503 171.4
[M+K]+ 221.093838 148.3
[M+H-H2O]+ 165.127940 142.3
[M+HCOO]- 227.128881 161.7
[M+CH3COO]- 241.144531 157.0
[M+Na-2H]- 203.105346 144.6
[M]+ 182.13013142 141.8
[M]- 182.13122858 141.8
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

patents stripe