CID 84670909

1782475-64-2

Structural Information

Molecular Formula

C₁₀H₂₂N₂O₂

SMILES

CC(CCNC(=O)OC(C)(C)C)NC

InChI

InChI=1S/C10H22N2O2/c1-8(11-5)6-7-12-9(13)14-10(2,3)4/h8,11H,6-7H2,1-5H3,(H,12,13)

InChIKey

RDMLKVWMUSZEGD-UHFFFAOYSA-N

Compound name

tert-butyl N-[3-(methylamino)butyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 202.16812 Da
Monoisotopic Mass: 1.3
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]+	203.17540	150.0
[M+Na]+	225.15734	156.3
[M+NH4]+	220.20194	155.7
[M+K]+	241.13128	153.0
[M-H]-	201.16084	148.5
[M+Na-2H]-	223.14279	151.5
[M]+	202.16757	150.0
[M]-	202.16867	150.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe