CID 137838069

2138347-99-4

Structural Information

Molecular Formula
C7H11NO
SMILES
C1C2C1C3(CNC3)OC2
InChI
InChI=1S/C7H11NO/c1-5-2-9-7(6(1)5)3-8-4-7/h5-6,8H,1-4H2
InChIKey
JYUIRDKJORYXRV-UHFFFAOYSA-N
Compound name
spiro[3-oxabicyclo[3.1.0]hexane-2,3'-azetidine]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

125.08406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.09134 121.7
[M+Na]+ 148.07328 130.4
[M-H]- 124.07678 127.2
[M+NH4]+ 143.11788 134.7
[M+K]+ 164.04722 131.9
[M+H-H2O]+ 108.08132 112.8
[M+HCOO]- 170.08226 139.1
[M+CH3COO]- 184.09791 135.0
[M+Na-2H]- 146.05873 130.1
[M]+ 125.08351 129.9
[M]- 125.08461 129.9
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.