CID 146075376

3-[amino(cyclopropyl)methyl]oxetan-3-ol

Structural Information

Molecular Formula
C7H13NO2
SMILES
C1CC1C(C2(COC2)O)N
InChI
InChI=1S/C7H13NO2/c8-6(5-1-2-5)7(9)3-10-4-7/h5-6,9H,1-4,8H2
InChIKey
OVRVPJDKUQAXMK-UHFFFAOYSA-N
Compound name
3-[amino(cyclopropyl)methyl]oxetan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

143.09464 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 127.1
[M+Na]+ 166.083858 133.3
[M-H]- 142.087364 133.6
[M+NH4]+ 161.128463 136.9
[M+K]+ 182.057798 136.4
[M+H-H2O]+ 126.091900 117.5
[M+HCOO]- 188.092841 146.4
[M+CH3COO]- 202.108491 179.7
[M+Na-2H]- 164.069306 133.7
[M]+ 143.09409142 135.2
[M]- 143.09518858 135.2
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

patents stripe