CID 63622356

N-(oxetan-3-yl)oxan-4-amine

Structural Information

Molecular Formula
C8H15NO2
SMILES
C1COCCC1NC2COC2
InChI
InChI=1S/C8H15NO2/c1-3-10-4-2-7(1)9-8-5-11-6-8/h7-9H,1-6H2
InChIKey
VLTVCFSSRRWWPW-UHFFFAOYSA-N
Compound name
N-(oxetan-3-yl)oxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.117556 125.7
[M+Na]+ 180.099498 127.8
[M-H]- 156.103004 132.3
[M+NH4]+ 175.144103 136.7
[M+K]+ 196.073438 133.0
[M+H-H2O]+ 140.107540 114.2
[M+HCOO]- 202.108481 144.2
[M+CH3COO]- 216.124131 180.1
[M+Na-2H]- 178.084946 133.7
[M]+ 157.10973142 130.1
[M]- 157.11082858 130.1
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.