CID 494850

Nsc633875

Structural Information

Molecular Formula
C14H26N2O4
SMILES
CCCCN1C(C(C1=O)(NC(=O)C)O)COC(C)(C)C
InChI
InChI=1S/C14H26N2O4/c1-6-7-8-16-11(9-20-13(3,4)5)14(19,12(16)18)15-10(2)17/h11,19H,6-9H2,1-5H3,(H,15,17)
InChIKey
ZYMBCCNNTASZRJ-UHFFFAOYSA-N
Compound name
N-[1-butyl-3-hydroxy-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

286.18927 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.19655 172.7
[M+Na]+ 309.17849 176.9
[M-H]- 285.18199 173.3
[M+NH4]+ 304.22309 182.1
[M+K]+ 325.15243 179.0
[M+H-H2O]+ 269.18653 162.4
[M+HCOO]- 331.18747 188.7
[M+CH3COO]- 345.20312 206.3
[M+Na-2H]- 307.16394 173.6
[M]+ 286.18872 184.6
[M]- 286.18982 184.6
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.