CID 68166152

(2-ethyl-1,3-oxazol-4-yl)methanamine

Structural Information

Molecular Formula
C6H10N2O
SMILES
CCC1=NC(=CO1)CN
InChI
InChI=1S/C6H10N2O/c1-2-6-8-5(3-7)4-9-6/h4H,2-3,7H2,1H3
InChIKey
SHYNDGLQFBPFKG-UHFFFAOYSA-N
Compound name
(2-ethyl-1,3-oxazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

126.079315 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.086591 124.0
[M+Na]+ 149.068533 132.8
[M-H]- 125.072039 126.9
[M+NH4]+ 144.113138 145.2
[M+K]+ 165.042473 132.7
[M+H-H2O]+ 109.076575 118.0
[M+HCOO]- 171.077516 148.7
[M+CH3COO]- 185.093166 172.1
[M+Na-2H]- 147.053981 131.0
[M]+ 126.07876642 124.7
[M]- 126.07986358 124.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe