CID 84046733

2375269-32-0

Structural Information

Molecular Formula
C7H16N2
SMILES
CN(C)CCC1CNC1
InChI
InChI=1S/C7H16N2/c1-9(2)4-3-7-5-8-6-7/h7-8H,3-6H2,1-2H3
InChIKey
WMXOYGGQFXYTNA-UHFFFAOYSA-N
Compound name
2-(azetidin-3-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

128.13135 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.138626 130.8
[M+Na]+ 151.120568 134.8
[M-H]- 127.124074 132.5
[M+NH4]+ 146.165173 144.7
[M+K]+ 167.094508 137.7
[M+H-H2O]+ 111.128610 119.2
[M+HCOO]- 173.129551 151.2
[M+CH3COO]- 187.145201 179.9
[M+Na-2H]- 149.106016 135.9
[M]+ 128.13080142 137.2
[M]- 128.13189858 137.2
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

No patent data available for this compound.