CID 213088

Brn 1875733

Structural Information

Molecular Formula
C9H14N2O4
SMILES
CC(CC#C)(COC(=O)N)COC(=O)N
InChI
InChI=1S/C9H14N2O4/c1-3-4-9(2,5-14-7(10)12)6-15-8(11)13/h1H,4-6H2,2H3,(H2,10,12)(H2,11,13)
InChIKey
NJPNQDCWBKBBLC-UHFFFAOYSA-N
Compound name
[2-(carbamoyloxymethyl)-2-methylpent-4-ynyl] carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.09535 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.10263 148.3
[M+Na]+ 237.08457 153.8
[M+NH4]+ 232.12917 149.2
[M+K]+ 253.05851 149.1
[M-H]- 213.08807 137.6
[M+Na-2H]- 235.07002 145.9
[M]+ 214.09480 144.7
[M]- 214.09590 144.7
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.