CID 96217310

2445749-47-1

Structural Information

Molecular Formula
C5H11NO
SMILES
C1C[C@@H]([C@@H]1CN)O
InChI
InChI=1S/C5H11NO/c6-3-4-1-2-5(4)7/h4-5,7H,1-3,6H2/t4-,5-/m0/s1
InChIKey
QHFFTNZUBMAJDN-WHFBIAKZSA-N
Compound name
(1S,2S)-2-(aminomethyl)cyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

101.08406 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.09134 119.6
[M+Na]+ 124.07328 125.0
[M-H]- 100.07678 121.5
[M+NH4]+ 119.11788 135.2
[M+K]+ 140.04722 127.2
[M+H-H2O]+ 84.081320 109.7
[M+HCOO]- 146.08226 141.0
[M+CH3COO]- 160.09791 170.4
[M+Na-2H]- 122.05873 124.8
[M]+ 101.08351 124.3
[M]- 101.08461 124.3
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.