CID 67957499

1262787-58-5

Structural Information

Molecular Formula
C12H24N2O3
SMILES
CC(C)(C)OC(=O)NC1(CCNCC1)COC
InChI
InChI=1S/C12H24N2O3/c1-11(2,3)17-10(15)14-12(9-16-4)5-7-13-8-6-12/h13H,5-9H2,1-4H3,(H,14,15)
InChIKey
OEDDMSWXGNFBJQ-UHFFFAOYSA-N
Compound name
tert-butyl N-[4-(methoxymethyl)piperidin-4-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

244.1787 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.185976 159.5
[M+Na]+ 267.167918 162.7
[M-H]- 243.171424 159.2
[M+NH4]+ 262.212523 176.5
[M+K]+ 283.141858 162.0
[M+H-H2O]+ 227.175960 153.8
[M+HCOO]- 289.176901 175.3
[M+CH3COO]- 303.192551 190.4
[M+Na-2H]- 265.153366 164.0
[M]+ 244.17815142 156.8
[M]- 244.17924858 156.8
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