CID 137943934

Rac-(1r,4s)-4-amino-2,2-dimethylcyclobutan-1-ol hydrochloride

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1(C[C@H]([C@H]1O)N)C
InChI
InChI=1S/C6H13NO/c1-6(2)3-4(7)5(6)8/h4-5,8H,3,7H2,1-2H3/t4-,5-/m1/s1
InChIKey
QYCHUZANHKSCQJ-RFZPGFLSSA-N
Compound name
trans-(1S,4R)-4-amino-2,2-dimethylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

115.09972 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.106996 125.3
[M+Na]+ 138.088938 132.1
[M-H]- 114.092444 127.9
[M+NH4]+ 133.133543 142.7
[M+K]+ 154.062878 134.0
[M+H-H2O]+ 98.096980 117.0
[M+HCOO]- 160.097921 146.3
[M+CH3COO]- 174.113571 174.1
[M+Na-2H]- 136.074386 130.3
[M]+ 115.09917142 131.1
[M]- 115.10026858 131.1
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.