CID 10558637

(2,4-dimethyl-1,3-oxazol-5-yl)methanol

Structural Information

Molecular Formula
C6H9NO2
SMILES
CC1=C(OC(=N1)C)CO
InChI
InChI=1S/C6H9NO2/c1-4-6(3-8)9-5(2)7-4/h8H,3H2,1-2H3
InChIKey
BFWHIILNKOBBPE-UHFFFAOYSA-N
Compound name
(2,4-dimethyl-1,3-oxazol-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

127.06333 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.07061 123.1
[M+Na]+ 150.05255 135.0
[M+NH4]+ 145.09715 131.0
[M+K]+ 166.02649 132.3
[M-H]- 126.05605 124.6
[M+Na-2H]- 148.03800 127.8
[M]+ 127.06278 125.1
[M]- 127.06388 125.1
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