CID 137698891

Tert-butyl n-[1-(2-methoxyacetyl)cyclopropyl]carbamate

Structural Information

Molecular Formula
C11H19NO4
SMILES
CC(C)(C)OC(=O)NC1(CC1)C(=O)COC
InChI
InChI=1S/C11H19NO4/c1-10(2,3)16-9(14)12-11(5-6-11)8(13)7-15-4/h5-7H2,1-4H3,(H,12,14)
InChIKey
PQSFFOCJVUPVCU-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(2-methoxyacetyl)cyclopropyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.13141 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.13869 152.5
[M+Na]+ 252.12063 160.1
[M-H]- 228.12413 157.1
[M+NH4]+ 247.16523 167.6
[M+K]+ 268.09457 159.6
[M+H-H2O]+ 212.12867 148.2
[M+HCOO]- 274.12961 173.5
[M+CH3COO]- 288.14526 194.1
[M+Na-2H]- 250.10608 157.7
[M]+ 229.13086 159.1
[M]- 229.13196 159.1
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.