CID 62906909

4-methyl-3-(oxan-4-yl)-1,2-oxazol-5-amine

Structural Information

Molecular Formula
C9H14N2O2
SMILES
CC1=C(ON=C1C2CCOCC2)N
InChI
InChI=1S/C9H14N2O2/c1-6-8(11-13-9(6)10)7-2-4-12-5-3-7/h7H,2-5,10H2,1H3
InChIKey
ROCOXESJNLSOFA-UHFFFAOYSA-N
Compound name
4-methyl-3-(oxan-4-yl)-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

182.10553 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.11281 139.6
[M+Na]+ 205.09475 146.3
[M-H]- 181.09825 145.6
[M+NH4]+ 200.13935 156.7
[M+K]+ 221.06869 146.6
[M+H-H2O]+ 165.10279 132.7
[M+HCOO]- 227.10373 159.7
[M+CH3COO]- 241.11938 181.3
[M+Na-2H]- 203.08020 144.2
[M]+ 182.10498 137.0
[M]- 182.10608 137.0
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