CID 6444876

Brn 4251577

Structural Information

Molecular Formula
C15H19NO
SMILES
CC1CC(N=C(O1)/C=C/C2=CC=CC=C2)(C)C
InChI
InChI=1S/C15H19NO/c1-12-11-15(2,3)16-14(17-12)10-9-13-7-5-4-6-8-13/h4-10,12H,11H2,1-3H3/b10-9+
InChIKey
NCLUYJLNJLCPBH-MDZDMXLPSA-N
Compound name
4,4,6-trimethyl-2-[(E)-2-phenylethenyl]-5,6-dihydro-1,3-oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.14667 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.15395 154.1
[M+Na]+ 252.13589 168.8
[M+NH4]+ 247.18049 164.3
[M+K]+ 268.10983 158.9
[M-H]- 228.13939 159.8
[M+Na-2H]- 250.12134 163.5
[M]+ 229.14612 158.2
[M]- 229.14722 158.2
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

No patent data available for this compound.