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]+ 233.07431 147.4
[M+Na]+ 255.05625 154.4
[M-H]- 231.05975 151.3
[M+NH4]+ 250.10085 166.0
[M+K]+ 271.03019 149.9
[M+H-H2O]+ 215.06429 140.8
[M+HCOO]- 277.06523 166.4
[M+CH3COO]- 291.08088 193.2
[M+Na-2H]- 253.04170 152.7
[M]+ 232.06648 147.4
[M]- 232.06758 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.