CID 21720160

1214031-03-4

Structural Information

Molecular Formula

C₇H₁₆N₂O

SMILES

CC(C(=O)NC(C)(C)C)N

InChI

InChI=1S/C7H16N2O/c1-5(8)6(10)9-7(2,3)4/h5H,8H2,1-4H3,(H,9,10)

InChIKey

GFAYBPQOURTWMC-UHFFFAOYSA-N

Compound name

2-amino-N-tert-butylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 144.12627 Da
Monoisotopic Mass: 0.0
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]+	145.133546	134.4
[M+Na]+	167.115488	139.9
[M-H]-	143.118994	134.4
[M+NH4]+	162.160093	155.3
[M+K]+	183.089428	140.2
[M+H-H2O]+	127.123530	129.7
[M+HCOO]-	189.124471	156.2
[M+CH3COO]-	203.140121	180.9
[M+Na-2H]-	165.100936	138.3
[M]+	144.12572142	132.1
[M]-	144.12681858	132.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe