CID 62385181

3-[(oxan-4-yl)methyl]azetidine hydrochloride

Structural Information

Molecular Formula
C9H17NO
SMILES
C1COCCC1CC2CNC2
InChI
InChI=1S/C9H17NO/c1-3-11-4-2-8(1)5-9-6-10-7-9/h8-10H,1-7H2
InChIKey
FIJZVMPMSOMGCE-UHFFFAOYSA-N
Compound name
3-(oxan-4-ylmethyl)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 134.0
[M+Na]+ 178.12023 139.9
[M+NH4]+ 173.16483 138.8
[M+K]+ 194.09417 136.2
[M-H]- 154.12373 135.0
[M+Na-2H]- 176.10568 136.7
[M]+ 155.13046 133.8
[M]- 155.13156 133.8
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.