CID 171938

Einecs 267-464-6

Structural Information

Molecular Formula
C9H15NO2
SMILES
CC1(CC(OC(=N1)C=C)(C)O)C
InChI
InChI=1S/C9H15NO2/c1-5-7-10-8(2,3)6-9(4,11)12-7/h5,11H,1,6H2,2-4H3
InChIKey
BMVDEFDNJLUPIK-UHFFFAOYSA-N
Compound name
2-ethenyl-4,4,6-trimethyl-5H-1,3-oxazin-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

169.11028 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.11756 133.1
[M+Na]+ 192.09950 142.1
[M-H]- 168.10300 135.3
[M+NH4]+ 187.14410 154.8
[M+K]+ 208.07344 141.8
[M+H-H2O]+ 152.10754 129.0
[M+HCOO]- 214.10848 151.8
[M+CH3COO]- 228.12413 176.8
[M+Na-2H]- 190.08495 141.1
[M]+ 169.10973 133.2
[M]- 169.11083 133.2
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