CID 65249847

1-(3-aminoazetidin-1-yl)-2-methylpropan-2-ol

Structural Information

Molecular Formula
C7H16N2O
SMILES
CC(C)(CN1CC(C1)N)O
InChI
InChI=1S/C7H16N2O/c1-7(2,10)5-9-3-6(8)4-9/h6,10H,3-5,8H2,1-2H3
InChIKey
VBUUFYODLOQWGP-UHFFFAOYSA-N
Compound name
1-(3-aminoazetidin-1-yl)-2-methylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

144.12627 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.133546 135.4
[M+Na]+ 167.115488 140.3
[M-H]- 143.118994 135.7
[M+NH4]+ 162.160093 148.1
[M+K]+ 183.089428 142.3
[M+H-H2O]+ 127.123530 124.6
[M+HCOO]- 189.124471 153.2
[M+CH3COO]- 203.140121 179.2
[M+Na-2H]- 165.100936 139.8
[M]+ 144.12572142 140.8
[M]- 144.12681858 140.8
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