CID 19081107

Tert-butyl n-(morpholin-2-ylmethyl)carbamate

Structural Information

Molecular Formula

C₁₀H₂₀N₂O₃

SMILES

CC(C)(C)OC(=O)NCC1CNCCO1

InChI

InChI=1S/C10H20N2O3/c1-10(2,3)15-9(13)12-7-8-6-11-4-5-14-8/h8,11H,4-7H2,1-3H3,(H,12,13)

InChIKey

IYHJNCQAADULQE-UHFFFAOYSA-N

Compound name

tert-butyl N-(morpholin-2-ylmethyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 485
Patents: 216.1474 Da
Monoisotopic Mass: 0.2
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]+	217.154676	151.8
[M+Na]+	239.136618	155.1
[M-H]-	215.140124	152.2
[M+NH4]+	234.181223	166.6
[M+K]+	255.110558	155.3
[M+H-H2O]+	199.144660	145.2
[M+HCOO]-	261.145601	167.4
[M+CH3COO]-	275.161251	184.9
[M+Na-2H]-	237.122066	156.9
[M]+	216.14685142	148.6
[M]-	216.14794858	148.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe