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

128
Patents

126.079315 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.086591 123.9
[M+Na]+ 149.068533 133.6
[M-H]- 125.072039 127.2
[M+NH4]+ 144.113138 145.4
[M+K]+ 165.042473 133.5
[M+H-H2O]+ 109.076575 118.3
[M+HCOO]- 171.077516 148.6
[M+CH3COO]- 185.093166 173.3
[M+Na-2H]- 147.053981 130.2
[M]+ 126.07876642 125.0
[M]- 126.07986358 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