CID 167714747

3-(prop-2-en-1-yl)oxetan-3-amine hydrochloride

Structural Information

Molecular Formula
C6H11NO
SMILES
C=CCC1(COC1)N
InChI
InChI=1S/C6H11NO/c1-2-3-6(7)4-8-5-6/h2H,1,3-5,7H2
InChIKey
MANWBGZMFUYKBU-UHFFFAOYSA-N
Compound name
3-prop-2-enyloxetan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

113.08406 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 121.5
[M+Na]+ 136.07328 127.3
[M-H]- 112.07678 125.4
[M+NH4]+ 131.11788 137.8
[M+K]+ 152.04722 130.5
[M+H-H2O]+ 96.081320 112.6
[M+HCOO]- 158.08226 143.5
[M+CH3COO]- 172.09791 173.4
[M+Na-2H]- 134.05873 129.7
[M]+ 113.08351 128.4
[M]- 113.08461 128.4
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.