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]+ 280.169596 167.6
[M+Na]+ 302.151538 175.8
[M-H]- 278.155044 174.2
[M+NH4]+ 297.196143 184.1
[M+K]+ 318.125478 171.5
[M+H-H2O]+ 262.159580 158.7
[M+HCOO]- 324.160521 185.3
[M+CH3COO]- 338.176171 179.0
[M+Na-2H]- 300.136986 173.4
[M]+ 279.16177142 167.3
[M]- 279.16286858 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.