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

187
Patents

228.18378 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.191056 156.8
[M+Na]+ 251.172998 160.2
[M-H]- 227.176504 156.6
[M+NH4]+ 246.217603 174.5
[M+K]+ 267.146938 158.9
[M+H-H2O]+ 211.181040 151.3
[M+HCOO]- 273.181981 172.4
[M+CH3COO]- 287.197631 188.3
[M+Na-2H]- 249.158446 161.2
[M]+ 228.18323142 152.6
[M]- 228.18432858 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