CID 165992545

2770500-22-4

Structural Information

Molecular Formula
C12H21NO2
SMILES
CC1(CC(=C)C1)CNC(=O)OC(C)(C)C
InChI
InChI=1S/C12H21NO2/c1-9-6-12(5,7-9)8-13-10(14)15-11(2,3)4/h1,6-8H2,2-5H3,(H,13,14)
InChIKey
BVPDUMQFFDAWCA-UHFFFAOYSA-N
Compound name
tert-butyl N-[(1-methyl-3-methylidenecyclobutyl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.15723 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.164506 153.2
[M+Na]+ 234.146448 157.8
[M-H]- 210.149954 156.6
[M+NH4]+ 229.191053 167.5
[M+K]+ 250.120388 159.8
[M+H-H2O]+ 194.154490 144.1
[M+HCOO]- 256.155431 172.5
[M+CH3COO]- 270.171081 193.1
[M+Na-2H]- 232.131896 156.8
[M]+ 211.15668142 162.3
[M]- 211.15777858 162.3
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

No patent data available for this compound.