CID 14409445

Tert-butyl n-(6-oxo-3,6-dihydro-2h-pyran-3-yl)carbamate

Structural Information

Molecular Formula
C10H15NO4
SMILES
CC(C)(C)OC(=O)NC1COC(=O)C=C1
InChI
InChI=1S/C10H15NO4/c1-10(2,3)15-9(13)11-7-4-5-8(12)14-6-7/h4-5,7H,6H2,1-3H3,(H,11,13)
InChIKey
XAFFTECTADZLNW-UHFFFAOYSA-N
Compound name
tert-butyl N-(6-oxo-2,3-dihydropyran-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.10011 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.10739 145.7
[M+Na]+ 236.08933 151.6
[M-H]- 212.09283 149.9
[M+NH4]+ 231.13393 163.0
[M+K]+ 252.06327 152.6
[M+H-H2O]+ 196.09737 140.1
[M+HCOO]- 258.09831 166.0
[M+CH3COO]- 272.11396 186.8
[M+Na-2H]- 234.07478 151.9
[M]+ 213.09956 146.5
[M]- 213.10066 146.5
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.