CID 64157435

1196154-38-7

Structural Information

Molecular Formula

C₈H₁₄N₂O

SMILES

CC(C)(C)C1=NOC(=C1)CN

InChI

InChI=1S/C8H14N2O/c1-8(2,3)7-4-6(5-9)11-10-7/h4H,5,9H2,1-3H3

InChIKey

RVDSUZZDSIKIBX-UHFFFAOYSA-N

Compound name

(3-tert-butyl-1,2-oxazol-5-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 154.11061 Da
Monoisotopic Mass: 1.0
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]+	155.11789	133.8
[M+Na]+	177.09983	142.2
[M-H]-	153.10333	136.7
[M+NH4]+	172.14443	154.1
[M+K]+	193.07377	142.1
[M+H-H2O]+	137.10787	128.2
[M+HCOO]-	199.10881	156.3
[M+CH3COO]-	213.12446	177.9
[M+Na-2H]-	175.08528	140.4
[M]+	154.11006	134.6
[M]-	154.11116	134.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe