CID 9570739

1519 cb

Structural Information

Molecular Formula
C19H23N3OS
SMILES
C/C(=N\O)/C1=C2C(=CC=C1)SC3=CC=CC=C3N2CCCN(C)C
InChI
InChI=1S/C19H23N3OS/c1-14(20-23)15-8-6-11-18-19(15)22(13-7-12-21(2)3)16-9-4-5-10-17(16)24-18/h4-6,8-11,23H,7,12-13H2,1-3H3/b20-14+
InChIKey
VHUSVBNGMNMLAF-XSFVSMFZSA-N
Compound name
(NE)-N-[1-[10-[3-(dimethylamino)propyl]phenothiazin-1-yl]ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.1562 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.16348 178.4
[M+Na]+ 364.14542 184.2
[M-H]- 340.14892 182.7
[M+NH4]+ 359.19002 193.3
[M+K]+ 380.11936 179.7
[M+H-H2O]+ 324.15346 169.8
[M+HCOO]- 386.15440 193.1
[M+CH3COO]- 400.17005 221.1
[M+Na-2H]- 362.13087 181.9
[M]+ 341.15565 181.7
[M]- 341.15675 181.7
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.