CID 23004744

Tert-butyl n-methyl-n-[(piperidin-3-yl)methyl]carbamate

Structural Information

Molecular Formula
C12H24N2O2
SMILES
CC(C)(C)OC(=O)N(C)CC1CCCNC1
InChI
InChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)14(4)9-10-6-5-7-13-8-10/h10,13H,5-9H2,1-4H3
InChIKey
HQZPRFQKDGVCLB-UHFFFAOYSA-N
Compound name
tert-butyl N-methyl-N-(piperidin-3-ylmethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
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 159.4
[M-H]- 227.176504 157.8
[M+NH4]+ 246.217603 173.1
[M+K]+ 267.146938 159.2
[M+H-H2O]+ 211.181040 150.1
[M+HCOO]- 273.181981 172.9
[M+CH3COO]- 287.197631 192.2
[M+Na-2H]- 249.158446 159.2
[M]+ 228.18323142 153.5
[M]- 228.18432858 153.5
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