CID 83669917

1526835-41-5

Structural Information

Molecular Formula
C12H24N2O2
SMILES
CC1CC(CN(C1)C(=O)OC(C)(C)C)CN
InChI
InChI=1S/C12H24N2O2/c1-9-5-10(6-13)8-14(7-9)11(15)16-12(2,3)4/h9-10H,5-8,13H2,1-4H3
InChIKey
IWBKPBIDPNSGCH-UHFFFAOYSA-N
Compound name
tert-butyl 3-(aminomethyl)-5-methylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.18378 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.191056 156.9
[M+Na]+ 251.172998 161.7
[M-H]- 227.176504 158.0
[M+NH4]+ 246.217603 173.7
[M+K]+ 267.146938 160.6
[M+H-H2O]+ 211.181040 150.7
[M+HCOO]- 273.181981 173.3
[M+CH3COO]- 287.197631 193.1
[M+Na-2H]- 249.158446 158.0
[M]+ 228.18323142 154.0
[M]- 228.18432858 154.0
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.