CID 177798368

(1r)-1-(1,3-oxazol-5-yl)propan-1-ol

Structural Information

Molecular Formula
C6H9NO2
SMILES
CC[C@H](C1=CN=CO1)O
InChI
InChI=1S/C6H9NO2/c1-2-5(8)6-3-7-4-9-6/h3-5,8H,2H2,1H3/t5-/m1/s1
InChIKey
LSXIHSFKTSLCEW-RXMQYKEDSA-N
Compound name
(1R)-1-(1,3-oxazol-5-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

127.06333 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.070606 123.9
[M+Na]+ 150.052548 131.8
[M-H]- 126.056054 125.6
[M+NH4]+ 145.097153 144.5
[M+K]+ 166.026488 132.3
[M+H-H2O]+ 110.060590 118.3
[M+HCOO]- 172.061531 145.9
[M+CH3COO]- 186.077181 167.1
[M+Na-2H]- 148.037996 130.5
[M]+ 127.06278142 124.9
[M]- 127.06387858 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

No patent data available for this compound.