CID 105503849

1785324-09-5

Structural Information

Molecular Formula
C13H26N2O2
SMILES
CC1(CC(CN(C1)C(=O)OC(C)(C)C)CN)C
InChI
InChI=1S/C13H26N2O2/c1-12(2,3)17-11(16)15-8-10(7-14)6-13(4,5)9-15/h10H,6-9,14H2,1-5H3
InChIKey
VFWAFEPLRDWSEU-UHFFFAOYSA-N
Compound name
tert-butyl 5-(aminomethyl)-3,3-dimethylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.19943 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.206706 159.6
[M+Na]+ 265.188648 164.9
[M-H]- 241.192154 160.9
[M+NH4]+ 260.233253 177.9
[M+K]+ 281.162588 164.0
[M+H-H2O]+ 225.196690 154.3
[M+HCOO]- 287.197631 175.7
[M+CH3COO]- 301.213281 195.7
[M+Na-2H]- 263.174096 161.7
[M]+ 242.19888142 157.4
[M]- 242.19997858 157.4
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.