CID 65959735

N-(oxan-4-yl)azetidin-3-amine dihydrochloride

Structural Information

Molecular Formula
C8H16N2O
SMILES
C1COCCC1NC2CNC2
InChI
InChI=1S/C8H16N2O/c1-3-11-4-2-7(1)10-8-5-9-6-8/h7-10H,1-6H2
InChIKey
PAXGUVRGBMCJIR-UHFFFAOYSA-N
Compound name
N-(oxan-4-yl)azetidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

156.12627 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.13355 130.1
[M+Na]+ 179.11549 131.9
[M-H]- 155.11899 133.2
[M+NH4]+ 174.16009 140.3
[M+K]+ 195.08943 134.6
[M+H-H2O]+ 139.12353 117.6
[M+HCOO]- 201.12447 146.5
[M+CH3COO]- 215.14012 178.0
[M+Na-2H]- 177.10094 136.4
[M]+ 156.12572 131.2
[M]- 156.12682 131.2
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