CID 13813928

1-ethylazetidin-3-ol

Structural Information

Molecular Formula
C5H11NO
SMILES
CCN1CC(C1)O
InChI
InChI=1S/C5H11NO/c1-2-6-3-5(7)4-6/h5,7H,2-4H2,1H3
InChIKey
ZMXWVFGREWGXIE-UHFFFAOYSA-N
Compound name
1-ethylazetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

224
Patents

101.08406 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.091336 118.1
[M+Na]+ 124.073278 124.6
[M-H]- 100.076784 119.1
[M+NH4]+ 119.117883 133.1
[M+K]+ 140.047218 127.1
[M+H-H2O]+ 84.081320 108.1
[M+HCOO]- 146.082261 138.0
[M+CH3COO]- 160.097911 169.0
[M+Na-2H]- 122.058726 124.3
[M]+ 101.08351142 125.2
[M]- 101.08460858 125.2
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