CID 19795980

2094338-97-1

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC2(CCCN(C1)C2)CO
InChI
InChI=1S/C9H17NO/c11-8-9-3-1-5-10(7-9)6-2-4-9/h11H,1-8H2
InChIKey
QKPOFVXKUKGCEP-UHFFFAOYSA-N
Compound name
1-azabicyclo[3.3.1]nonan-5-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

155.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 135.7
[M+Na]+ 178.12023 140.2
[M-H]- 154.12373 134.7
[M+NH4]+ 173.16483 157.9
[M+K]+ 194.09417 138.2
[M+H-H2O]+ 138.12827 129.9
[M+HCOO]- 200.12921 150.0
[M+CH3COO]- 214.14486 173.4
[M+Na-2H]- 176.10568 143.4
[M]+ 155.13046 129.5
[M]- 155.13156 129.5
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

patents stripe