CID 115070698

2344680-89-1

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)(C)OCC1CNC1
InChI
InChI=1S/C8H17NO/c1-8(2,3)10-6-7-4-9-5-7/h7,9H,4-6H2,1-3H3
InChIKey
PXFRDCTYODEIRI-UHFFFAOYSA-N
Compound name
3-[(2-methylpropan-2-yl)oxymethyl]azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

143.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 133.4
[M+Na]+ 166.12023 138.3
[M-H]- 142.12373 133.9
[M+NH4]+ 161.16483 146.7
[M+K]+ 182.09417 140.4
[M+H-H2O]+ 126.12827 123.2
[M+HCOO]- 188.12921 150.9
[M+CH3COO]- 202.14486 176.4
[M+Na-2H]- 164.10568 139.2
[M]+ 143.13046 140.7
[M]- 143.13156 140.7
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