CID 9570399

Propionylpromazine oxime

Structural Information

Molecular Formula
C20H25N3OS
SMILES
CC/C(=N\O)/C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C
InChI
InChI=1S/C20H25N3OS/c1-4-16(21-24)15-10-11-20-18(14-15)23(13-7-12-22(2)3)17-8-5-6-9-19(17)25-20/h5-6,8-11,14,24H,4,7,12-13H2,1-3H3/b21-16+
InChIKey
HHWKJUYYGNRFJA-LTGZKZEYSA-N
Compound name
(NE)-N-[1-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]propylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.17184 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.17912 182.8
[M+Na]+ 378.16106 188.2
[M-H]- 354.16456 186.9
[M+NH4]+ 373.20566 197.0
[M+K]+ 394.13500 183.4
[M+H-H2O]+ 338.16910 174.0
[M+HCOO]- 400.17004 197.1
[M+CH3COO]- 414.18569 224.0
[M+Na-2H]- 376.14651 185.8
[M]+ 355.17129 186.4
[M]- 355.17239 186.4
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.