CID 365797

Nsc633872

Structural Information

Molecular Formula
C13H24N2O4
SMILES
CC(=O)NC1C(N(C1=O)CCOC)COC(C)(C)C
InChI
InChI=1S/C13H24N2O4/c1-9(16)14-11-10(8-19-13(2,3)4)15(12(11)17)6-7-18-5/h10-11H,6-8H2,1-5H3,(H,14,16)
InChIKey
SRVVNYAXZXNKJK-UHFFFAOYSA-N
Compound name
N-[1-(2-methoxyethyl)-2-[(2-methylpropan-2-yl)oxymethyl]-4-oxoazetidin-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.1736 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.180876 166.9
[M+Na]+ 295.162818 171.2
[M-H]- 271.166324 168.7
[M+NH4]+ 290.207423 175.6
[M+K]+ 311.136758 174.1
[M+H-H2O]+ 255.170860 154.9
[M+HCOO]- 317.171801 184.8
[M+CH3COO]- 331.187451 206.2
[M+Na-2H]- 293.148266 167.6
[M]+ 272.17305142 180.0
[M]- 272.17414858 180.0
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.