CID 167722061

1-[1-(2,2-dimethoxyethyl)cyclobutyl]methanamine

Structural Information

Molecular Formula
C9H19NO2
SMILES
COC(CC1(CCC1)CN)OC
InChI
InChI=1S/C9H19NO2/c1-11-8(12-2)6-9(7-10)4-3-5-9/h8H,3-7,10H2,1-2H3
InChIKey
UCHQLOBABAPRTN-UHFFFAOYSA-N
Compound name
[1-(2,2-dimethoxyethyl)cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.14159 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.14887 142.4
[M+Na]+ 196.13081 146.1
[M-H]- 172.13431 145.0
[M+NH4]+ 191.17541 157.4
[M+K]+ 212.10475 149.2
[M+H-H2O]+ 156.13885 132.4
[M+HCOO]- 218.13979 163.1
[M+CH3COO]- 232.15544 186.0
[M+Na-2H]- 194.11626 146.3
[M]+ 173.14104 151.1
[M]- 173.14214 151.1
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.