CID 71756834

4-ethyl-3-methoxyhexan-1-amine hydrochloride

Structural Information

Molecular Formula
C9H21NO
SMILES
CCC(CC)C(CCN)OC
InChI
InChI=1S/C9H21NO/c1-4-8(5-2)9(11-3)6-7-10/h8-9H,4-7,10H2,1-3H3
InChIKey
YTPZXTSSQYKMLB-UHFFFAOYSA-N
Compound name
4-ethyl-3-methoxyhexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.16231 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.16959 139.3
[M+Na]+ 182.15153 147.5
[M+NH4]+ 177.19613 146.7
[M+K]+ 198.12547 142.6
[M-H]- 158.15503 138.9
[M+Na-2H]- 180.13698 141.6
[M]+ 159.16176 140.0
[M]- 159.16286 140.0
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

No patent data available for this compound.