CID 86811647

1-(aminomethyl)-3-ethoxycyclobutan-1-ol

Structural Information

Molecular Formula
C7H15NO2
SMILES
CCOC1CC(C1)(CN)O
InChI
InChI=1S/C7H15NO2/c1-2-10-6-3-7(9,4-6)5-8/h6,9H,2-5,8H2,1H3
InChIKey
DCPRZZYRHNKGAE-UHFFFAOYSA-N
Compound name
1-(aminomethyl)-3-ethoxycyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.11028 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.11756 132.5
[M+Na]+ 168.09950 137.7
[M-H]- 144.10300 134.4
[M+NH4]+ 163.14410 148.2
[M+K]+ 184.07344 139.9
[M+H-H2O]+ 128.10754 123.3
[M+HCOO]- 190.10848 153.3
[M+CH3COO]- 204.12413 177.9
[M+Na-2H]- 166.08495 137.6
[M]+ 145.10973 139.6
[M]- 145.11083 139.6
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.