CID 121599410

1597677-85-4

Structural Information

Molecular Formula
C6H10N2O
SMILES
CC(C)C1=CON=C1N
InChI
InChI=1S/C6H10N2O/c1-4(2)5-3-9-8-6(5)7/h3-4H,1-2H3,(H2,7,8)
InChIKey
KQTORQVUWILGQO-UHFFFAOYSA-N
Compound name
4-propan-2-yl-1,2-oxazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

126.079315 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.086591 124.9
[M+Na]+ 149.068533 133.4
[M-H]- 125.072039 127.9
[M+NH4]+ 144.113138 146.0
[M+K]+ 165.042473 133.8
[M+H-H2O]+ 109.076575 119.0
[M+HCOO]- 171.077516 148.6
[M+CH3COO]- 185.093166 173.0
[M+Na-2H]- 147.053981 130.6
[M]+ 126.07876642 124.9
[M]- 126.07986358 124.9
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