CID 11018874

(dimethyl-1,2-oxazol-4-yl)methanamine

Structural Information

Molecular Formula
C6H10N2O
SMILES
CC1=C(C(=NO1)C)CN
InChI
InChI=1S/C6H10N2O/c1-4-6(3-7)5(2)9-8-4/h3,7H2,1-2H3
InChIKey
CXRIJWLNQSZJTG-UHFFFAOYSA-N
Compound name
(3,5-dimethyl-1,2-oxazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

124
Patents

126.079315 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.08659 123.9
[M+Na]+ 149.06853 133.6
[M-H]- 125.07204 127.2
[M+NH4]+ 144.11314 145.4
[M+K]+ 165.04247 133.5
[M+H-H2O]+ 109.07658 118.3
[M+HCOO]- 171.07752 148.6
[M+CH3COO]- 185.09317 173.3
[M+Na-2H]- 147.05398 130.2
[M]+ 126.07877 125.0
[M]- 126.07986 125.0
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