CID 22355254

770709-01-8

Structural Information

Molecular Formula
C6H13NO
SMILES
C1COCC1CCN
InChI
InChI=1S/C6H13NO/c7-3-1-6-2-4-8-5-6/h6H,1-5,7H2
InChIKey
CNWVPUYTZPMEDA-UHFFFAOYSA-N
Compound name
2-(oxolan-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

115.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 124.0
[M+Na]+ 138.08894 129.6
[M-H]- 114.09244 127.2
[M+NH4]+ 133.13354 146.3
[M+K]+ 154.06288 130.1
[M+H-H2O]+ 98.096980 118.8
[M+HCOO]- 160.09792 147.0
[M+CH3COO]- 174.11357 169.1
[M+Na-2H]- 136.07439 129.8
[M]+ 115.09917 120.8
[M]- 115.10027 120.8
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