CID 63788503

Tert-butyl n-(2-(dimethylamino)propyl)carbamate

Structural Information

Molecular Formula

C₁₀H₂₂N₂O₂

SMILES

CC(CNC(=O)OC(C)(C)C)N(C)C

InChI

InChI=1S/C10H22N2O2/c1-8(12(5)6)7-11-9(13)14-10(2,3)4/h8H,7H2,1-6H3,(H,11,13)

InChIKey

RJSJDCGEEPZUEX-UHFFFAOYSA-N

Compound name

tert-butyl N-[2-(dimethylamino)propyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 202.16812 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	203.175396	150.3
[M+Na]+	225.157338	154.8
[M-H]-	201.160844	151.9
[M+NH4]+	220.201943	169.9
[M+K]+	241.131278	156.7
[M+H-H2O]+	185.165380	144.8
[M+HCOO]-	247.166321	172.6
[M+CH3COO]-	261.181971	195.6
[M+Na-2H]-	223.142786	153.2
[M]+	202.16757142	152.9
[M]-	202.16866858	152.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe