CID 19101440

98430-09-2

Structural Information

Molecular Formula
C7H15NO
SMILES
C1CC(COC1)CCN
InChI
InChI=1S/C7H15NO/c8-4-3-7-2-1-5-9-6-7/h7H,1-6,8H2
InChIKey
XKNKOCGKABTGEP-UHFFFAOYSA-N
Compound name
2-(oxan-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

129.11537 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 128.4
[M+Na]+ 152.10459 132.7
[M-H]- 128.10809 131.2
[M+NH4]+ 147.14919 148.3
[M+K]+ 168.07853 133.0
[M+H-H2O]+ 112.11263 122.7
[M+HCOO]- 174.11357 148.9
[M+CH3COO]- 188.12922 172.4
[M+Na-2H]- 150.09004 134.9
[M]+ 129.11482 123.5
[M]- 129.11592 123.5
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