CID 40465333

Rac-(4ar,7r,8ar)-decahydroquinolin-7-ol

Structural Information

Molecular Formula
C9H17NO
SMILES
C1C[C@@H]2CC[C@H](C[C@H]2NC1)O
InChI
InChI=1S/C9H17NO/c11-8-4-3-7-2-1-5-10-9(7)6-8/h7-11H,1-6H2/t7-,8-,9-/m1/s1
InChIKey
CFYDLDXIZVAABZ-IWSPIJDZSA-N
Compound name
(4aR,7R,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 135.4
[M+Na]+ 178.12023 139.1
[M-H]- 154.12373 134.4
[M+NH4]+ 173.16483 154.4
[M+K]+ 194.09417 136.1
[M+H-H2O]+ 138.12827 129.4
[M+HCOO]- 200.12921 148.4
[M+CH3COO]- 214.14486 171.2
[M+Na-2H]- 176.10568 140.1
[M]+ 155.13046 125.5
[M]- 155.13156 125.5
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.