CID 58332169

1206824-89-6

Structural Information

Molecular Formula
C12H24N2O2
SMILES
C[C@@H]1CCNC[C@@H]1N(C)C(=O)OC(C)(C)C
InChI
InChI=1S/C12H24N2O2/c1-9-6-7-13-8-10(9)14(5)11(15)16-12(2,3)4/h9-10,13H,6-8H2,1-5H3/t9-,10+/m1/s1
InChIKey
GEUGTHQTDCPAHY-ZJUUUORDSA-N
Compound name
tert-butyl N-methyl-N-[(3R,4R)-4-methylpiperidin-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

228.18378 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.19106 156.3
[M+Na]+ 251.17300 159.9
[M-H]- 227.17650 157.7
[M+NH4]+ 246.21760 172.9
[M+K]+ 267.14694 159.7
[M+H-H2O]+ 211.18104 149.9
[M+HCOO]- 273.18198 172.4
[M+CH3COO]- 287.19763 193.4
[M+Na-2H]- 249.15845 158.1
[M]+ 228.18323 153.4
[M]- 228.18433 153.4
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

patents stripe