CID 102537928

(1s,3s)-3-amino-3-phenylcyclobutan-1-ol hydrochloride

Structural Information

Molecular Formula
C10H13NO
SMILES
C1C(CC1(C2=CC=CC=C2)N)O
InChI
InChI=1S/C10H13NO/c11-10(6-9(12)7-10)8-4-2-1-3-5-8/h1-5,9,12H,6-7,11H2
InChIKey
CLUVMSCHJKPZJM-UHFFFAOYSA-N
Compound name
3-amino-3-phenylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.09972 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.106996 134.9
[M+Na]+ 186.088938 140.8
[M-H]- 162.092444 140.0
[M+NH4]+ 181.133543 149.8
[M+K]+ 202.062878 141.1
[M+H-H2O]+ 146.096980 124.5
[M+HCOO]- 208.097921 156.4
[M+CH3COO]- 222.113571 180.2
[M+Na-2H]- 184.074386 141.1
[M]+ 163.09917142 139.5
[M]- 163.10026858 139.5
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.