CID 15399479

Tert-butyln-ethenyl-n-methylcarbamate

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC(C)(C)OC(=O)N(C)C=C
InChI
InChI=1S/C8H15NO2/c1-6-9(5)7(10)11-8(2,3)4/h6H,1H2,2-5H3
InChIKey
PMTSWHOQQMJIJJ-UHFFFAOYSA-N
Compound name
tert-butyl N-ethenyl-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

157.11028 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 134.6
[M+Na]+ 180.09950 141.5
[M-H]- 156.10300 136.7
[M+NH4]+ 175.14410 156.4
[M+K]+ 196.07344 142.7
[M+H-H2O]+ 140.10754 130.1
[M+HCOO]- 202.10848 157.8
[M+CH3COO]- 216.12413 182.7
[M+Na-2H]- 178.08495 139.8
[M]+ 157.10973 137.3
[M]- 157.11083 137.3
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

patents stripe