CID 165278

Morazine

Structural Information

Molecular Formula
C19H22N2OS
SMILES
C1COCCN1CCCN2C3=CC=CC=C3SC4=CC=CC=C42
InChI
InChI=1S/C19H22N2OS/c1-3-8-18-16(6-1)21(17-7-2-4-9-19(17)23-18)11-5-10-20-12-14-22-15-13-20/h1-4,6-9H,5,10-15H2
InChIKey
UALCBDFAIRGZSF-UHFFFAOYSA-N
Compound name
4-(3-phenothiazin-10-ylpropyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

16
Patents

326.1453 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.152576 173.0
[M+Na]+ 349.134518 178.5
[M-H]- 325.138024 177.5
[M+NH4]+ 344.179123 185.1
[M+K]+ 365.108458 173.5
[M+H-H2O]+ 309.142560 163.1
[M+HCOO]- 371.143501 181.5
[M+CH3COO]- 385.159151 181.8
[M+Na-2H]- 347.119966 177.2
[M]+ 326.14475142 171.4
[M]- 326.14584858 171.4
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