CID 20709354

874831-66-0

Structural Information

Molecular Formula

C₁₀H₂₂N₂O₂

SMILES

CC(C)(C)OC(=O)NCCCCNC

InChI

InChI=1S/C10H22N2O2/c1-10(2,3)14-9(13)12-8-6-5-7-11-4/h11H,5-8H2,1-4H3,(H,12,13)

InChIKey

TTYVTUUWVLXDKW-UHFFFAOYSA-N

Compound name

tert-butyl N-[4-(methylamino)butyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 170
Patents: 202.16812 Da
Monoisotopic Mass: 1.2
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	150.7
[M+Na]+	225.15734	155.1
[M-H]-	201.16084	150.6
[M+NH4]+	220.20194	169.5
[M+K]+	241.13128	155.0
[M+H-H2O]+	185.16538	145.1
[M+HCOO]-	247.16632	173.3
[M+CH3COO]-	261.18197	191.2
[M+Na-2H]-	223.14279	155.4
[M]+	202.16757	152.6
[M]-	202.16867	152.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe