CID 102938378

Tert-butyl 2-(aminomethyl)-6-methylmorpholine-4-carboxylate

Structural Information

Molecular Formula

C₁₁H₂₂N₂O₃

SMILES

CC1CN(CC(O1)CN)C(=O)OC(C)(C)C

InChI

InChI=1S/C11H22N2O3/c1-8-6-13(7-9(5-12)15-8)10(14)16-11(2,3)4/h8-9H,5-7,12H2,1-4H3

InChIKey

NRCWPEONLURCHH-UHFFFAOYSA-N

Compound name

tert-butyl 2-(aminomethyl)-6-methylmorpholine-4-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 230.16304 Da
Monoisotopic Mass: 0.3
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]+	231.170316	156.0
[M+Na]+	253.152258	161.2
[M-H]-	229.155764	157.9
[M+NH4]+	248.196863	171.3
[M+K]+	269.126198	161.7
[M+H-H2O]+	213.160300	149.6
[M+HCOO]-	275.161241	172.1
[M+CH3COO]-	289.176891	192.3
[M+Na-2H]-	251.137706	158.6
[M]+	230.16249142	154.8
[M]-	230.16358858	154.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe