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]+ 183.112806 139.6
[M+Na]+ 205.094748 146.3
[M-H]- 181.098254 145.6
[M+NH4]+ 200.139353 156.7
[M+K]+ 221.068688 146.6
[M+H-H2O]+ 165.102790 132.7
[M+HCOO]- 227.103731 159.7
[M+CH3COO]- 241.119381 181.3
[M+Na-2H]- 203.080196 144.2
[M]+ 182.10498142 137.0
[M]- 182.10607858 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