CID 41390

55299-24-6

Structural Information

Molecular Formula
C18H19ClN2OSi
SMILES
C[Si](C)(C)N1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3
InChI
InChI=1S/C18H19ClN2OSi/c1-23(2,3)21-16-10-9-14(19)11-15(16)18(20-12-17(21)22)13-7-5-4-6-8-13/h4-11H,12H2,1-3H3
InChIKey
JXTYHIJFKDXKHG-UHFFFAOYSA-N
Compound name
7-chloro-5-phenyl-1-trimethylsilyl-3H-1,4-benzodiazepin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.09552 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.10280 177.7
[M+Na]+ 365.08474 187.2
[M-H]- 341.08824 183.6
[M+NH4]+ 360.12934 190.8
[M+K]+ 381.05868 185.2
[M+H-H2O]+ 325.09278 169.2
[M+HCOO]- 387.09372 190.1
[M+CH3COO]- 401.10937 188.1
[M+Na-2H]- 363.07019 182.2
[M]+ 342.09497 177.6
[M]- 342.09607 177.6
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.