CID 130068053

1440960-96-2

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)(CC=C)N
InChI
InChI=1S/C13H24N2O2/c1-5-7-13(14)8-6-9-15(10-13)11(16)17-12(2,3)4/h5H,1,6-10,14H2,2-4H3
InChIKey
HLVLMAMGBKFODM-UHFFFAOYSA-N
Compound name
tert-butyl 3-amino-3-prop-2-enylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.18378 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.191056 159.0
[M+Na]+ 263.172998 163.6
[M-H]- 239.176504 159.9
[M+NH4]+ 258.217603 177.0
[M+K]+ 279.146938 162.1
[M+H-H2O]+ 223.181040 153.5
[M+HCOO]- 285.181981 175.4
[M+CH3COO]- 299.197631 193.6
[M+Na-2H]- 261.158446 161.8
[M]+ 240.18323142 155.8
[M]- 240.18432858 155.8
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.