CID 11970480

37139-42-7

Structural Information

Molecular Formula
C8H13NO
SMILES
CC1(CCOC(=N1)C=C)C
InChI
InChI=1S/C8H13NO/c1-4-7-9-8(2,3)5-6-10-7/h4H,1,5-6H2,2-3H3
InChIKey
WFBZXEPSOKWDHQ-UHFFFAOYSA-N
Compound name
2-ethenyl-4,4-dimethyl-5,6-dihydro-1,3-oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

139.09972 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.106996 127.4
[M+Na]+ 162.088938 135.4
[M-H]- 138.092444 130.4
[M+NH4]+ 157.133543 148.7
[M+K]+ 178.062878 135.5
[M+H-H2O]+ 122.096980 122.1
[M+HCOO]- 184.097921 147.7
[M+CH3COO]- 198.113571 173.4
[M+Na-2H]- 160.074386 135.7
[M]+ 139.09917142 126.7
[M]- 139.10026858 126.7
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