CID 44148440

73772-31-3

Structural Information

Molecular Formula
C19H24N3O
SMILES
CCNC1=CC2=C(C=C1C)N=C3C=CC(=[N+](CC)CC)C=C3O2
InChI
InChI=1S/C19H23N3O/c1-5-20-16-12-19-17(10-13(16)4)21-15-9-8-14(11-18(15)23-19)22(6-2)7-3/h8-12H,5-7H2,1-4H3/p+1
InChIKey
CDJFVIHDKLSFOR-UHFFFAOYSA-O
Compound name
diethyl-[7-(ethylamino)-8-methylphenoxazin-3-ylidene]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

310.19193 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.19921 176.9
[M+Na]+ 333.18115 184.8
[M-H]- 309.18465 183.2
[M+NH4]+ 328.22575 191.4
[M+K]+ 349.15509 175.7
[M+H-H2O]+ 293.18919 170.3
[M+HCOO]- 355.19013 197.8
[M+CH3COO]- 369.20578 210.8
[M+Na-2H]- 331.16660 186.1
[M]+ 310.19138 179.5
[M]- 310.19248 179.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe