CID 167718097

Rac-1-[(1r,2s)-2-(tert-butoxy)cyclobutyl]methanamine hydrochloride

Structural Information

Molecular Formula
C9H19NO
SMILES
CC(C)(C)O[C@@H]1CC[C@H]1CN
InChI
InChI=1S/C9H19NO/c1-9(2,3)11-8-5-4-7(8)6-10/h7-8H,4-6,10H2,1-3H3/t7-,8+/m0/s1
InChIKey
BCPWKBKIOFUMTD-JGVFFNPUSA-N
Compound name
[(1S,2R)-2-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.14667 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.153946 137.8
[M+Na]+ 180.135888 142.5
[M-H]- 156.139394 140.8
[M+NH4]+ 175.180493 152.2
[M+K]+ 196.109828 145.0
[M+H-H2O]+ 140.143930 127.7
[M+HCOO]- 202.144871 157.9
[M+CH3COO]- 216.160521 184.5
[M+Na-2H]- 178.121336 142.0
[M]+ 157.14612142 145.3
[M]- 157.14721858 145.3
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.