CID 6447781

100098-83-7

Structural Information

Molecular Formula
C19H21NO
SMILES
CC1CC(N=C(O1)/C=C/C2=CC=CC3=CC=CC=C32)(C)C
InChI
InChI=1S/C19H21NO/c1-14-13-19(2,3)20-18(21-14)12-11-16-9-6-8-15-7-4-5-10-17(15)16/h4-12,14H,13H2,1-3H3/b12-11+
InChIKey
JCFOYWGXUYMOAF-VAWYXSNFSA-N
Compound name
4,4,6-trimethyl-2-[(E)-2-naphthalen-1-ylethenyl]-5,6-dihydro-1,3-oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.16232 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.16960 167.6
[M+Na]+ 302.15154 175.8
[M-H]- 278.15504 174.2
[M+NH4]+ 297.19614 184.1
[M+K]+ 318.12548 171.5
[M+H-H2O]+ 262.15958 158.7
[M+HCOO]- 324.16052 185.3
[M+CH3COO]- 338.17617 179.0
[M+Na-2H]- 300.13699 173.4
[M]+ 279.16177 167.3
[M]- 279.16287 167.3
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.