CID 94088

Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride

Structural Information

Molecular Formula
C7H18N2O3SSi
SMILES
CO[Si](CCCSC(=N)N)(OC)OC
InChI
InChI=1S/C7H18N2O3SSi/c1-10-14(11-2,12-3)6-4-5-13-7(8)9/h4-6H2,1-3H3,(H3,8,9)
InChIKey
HTYZAYXDHKUMCW-UHFFFAOYSA-N
Compound name
3-trimethoxysilylpropyl carbamimidothioate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

185
Patents

238.08073 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.08801 153.0
[M+Na]+ 261.06995 158.4
[M+NH4]+ 256.11455 158.6
[M+K]+ 277.04389 153.5
[M-H]- 237.07345 151.1
[M+Na-2H]- 259.05540 153.5
[M]+ 238.08018 153.2
[M]- 238.08128 153.2
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

patents stripe