CID 6268331

Ethanimidamide, n-hydroxy-2-(1-naphthalenylthio)-, monohydrochloride

Structural Information

Molecular Formula
C12H12N2OS
SMILES
C1=CC=C2C(=C1)C=CC=C2SC/C(=N\O)/N
InChI
InChI=1S/C12H12N2OS/c13-12(14-15)8-16-11-7-3-5-9-4-1-2-6-10(9)11/h1-7,15H,8H2,(H2,13,14)
InChIKey
SSNCFEGYZLRAFM-UHFFFAOYSA-N
Compound name
N'-hydroxy-2-naphthalen-1-ylsulfanylethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.06703 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.074306 147.4
[M+Na]+ 255.056248 154.4
[M-H]- 231.059754 151.3
[M+NH4]+ 250.100853 166.0
[M+K]+ 271.030188 149.9
[M+H-H2O]+ 215.064290 140.8
[M+HCOO]- 277.065231 166.4
[M+CH3COO]- 291.080881 193.2
[M+Na-2H]- 253.041696 152.7
[M]+ 232.06648142 147.4
[M]- 232.06757858 147.4
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.