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]+ 144.10192 127.1
[M+Na]+ 166.08386 133.3
[M-H]- 142.08736 133.6
[M+NH4]+ 161.12846 136.9
[M+K]+ 182.05780 136.4
[M+H-H2O]+ 126.09190 117.5
[M+HCOO]- 188.09284 146.4
[M+CH3COO]- 202.10849 179.7
[M+Na-2H]- 164.06931 133.7
[M]+ 143.09409 135.2
[M]- 143.09519 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