CID 138040383

2243515-64-0

Structural Information

Molecular Formula
C12H21NO4
SMILES
CC(C)(C)OC(=O)NC(CC1CCCO1)C=O
InChI
InChI=1S/C12H21NO4/c1-12(2,3)17-11(15)13-9(8-14)7-10-5-4-6-16-10/h8-10H,4-7H2,1-3H3,(H,13,15)
InChIKey
WCXIEBYEAQBJHE-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-oxo-3-(oxolan-2-yl)propan-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.14706 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.15434 157.5
[M+Na]+ 266.13628 163.2
[M+NH4]+ 261.18088 162.8
[M+K]+ 282.11022 162.6
[M-H]- 242.13978 157.3
[M+Na-2H]- 264.12173 158.1
[M]+ 243.14651 157.7
[M]- 243.14761 157.7
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

No patent data available for this compound.