CID 70650847

1158759-03-5

Structural Information

Molecular Formula
C12H24N2O2
SMILES
CC1(CCNCC1)CNC(=O)OC(C)(C)C
InChI
InChI=1S/C12H24N2O2/c1-11(2,3)16-10(15)14-9-12(4)5-7-13-8-6-12/h13H,5-9H2,1-4H3,(H,14,15)
InChIKey
VKIYCSNDWNMPKU-UHFFFAOYSA-N
Compound name
tert-butyl N-[(4-methylpiperidin-4-yl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

247
Patents

228.18378 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.19106 156.8
[M+Na]+ 251.17300 160.2
[M-H]- 227.17650 156.6
[M+NH4]+ 246.21760 174.5
[M+K]+ 267.14694 158.9
[M+H-H2O]+ 211.18104 151.3
[M+HCOO]- 273.18198 172.4
[M+CH3COO]- 287.19763 188.3
[M+Na-2H]- 249.15845 161.2
[M]+ 228.18323 152.6
[M]- 228.18433 152.6
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