CID 21054629

1-(oxolan-3-yl)ethan-1-amine

Structural Information

Molecular Formula
C6H13NO
SMILES
CC(C1CCOC1)N
InChI
InChI=1S/C6H13NO/c1-5(7)6-2-3-8-4-6/h5-6H,2-4,7H2,1H3
InChIKey
JCIAQQOICXUMNX-UHFFFAOYSA-N
Compound name
1-(oxolan-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

115.09972 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 125.1
[M+Na]+ 138.08894 130.4
[M-H]- 114.09244 128.3
[M+NH4]+ 133.13354 147.4
[M+K]+ 154.06288 131.4
[M+H-H2O]+ 98.096980 119.9
[M+HCOO]- 160.09792 147.0
[M+CH3COO]- 174.11357 170.0
[M+Na-2H]- 136.07439 129.5
[M]+ 115.09917 121.2
[M]- 115.10027 121.2
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