CID 137838651

2137747-55-6

Structural Information

Molecular Formula
C10H16ClNO5
SMILES
CC(C)(C)OC(=O)NC1(COC1)C(=O)OCCl
InChI
InChI=1S/C10H16ClNO5/c1-9(2,3)17-8(14)12-10(4-15-5-10)7(13)16-6-11/h4-6H2,1-3H3,(H,12,14)
InChIKey
FNXKVXZZUANWDK-UHFFFAOYSA-N
Compound name
chloromethyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]oxetane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.0717 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.07898 153.4
[M+Na]+ 288.06092 158.0
[M-H]- 264.06442 157.3
[M+NH4]+ 283.10552 164.7
[M+K]+ 304.03486 161.5
[M+H-H2O]+ 248.06896 144.8
[M+HCOO]- 310.06990 168.0
[M+CH3COO]- 324.08555 196.2
[M+Na-2H]- 286.04637 159.0
[M]+ 265.07115 167.4
[M]- 265.07225 167.4
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.