CID 321466

3-aminononan-2-ol

Structural Information

Molecular Formula
C9H21NO
SMILES
CCCCCCC(C(C)O)N
InChI
InChI=1S/C9H21NO/c1-3-4-5-6-7-9(10)8(2)11/h8-9,11H,3-7,10H2,1-2H3
InChIKey
SKURPTBUALFOED-UHFFFAOYSA-N
Compound name
3-aminononan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

159.16231 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.169586 142.3
[M+Na]+ 182.151528 146.5
[M-H]- 158.155034 140.1
[M+NH4]+ 177.196133 162.0
[M+K]+ 198.125468 145.5
[M+H-H2O]+ 142.159570 137.1
[M+HCOO]- 204.160511 162.2
[M+CH3COO]- 218.176161 181.4
[M+Na-2H]- 180.136976 143.6
[M]+ 159.16176142 141.0
[M]- 159.16285858 141.0
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