CID 317663

2,2'-dithiodi(1-naphthylamine)

Structural Information

Molecular Formula
C20H16N2S2
SMILES
C1=CC=C2C(=C1)C=CC(=C2N)SSC3=C(C4=CC=CC=C4C=C3)N
InChI
InChI=1S/C20H16N2S2/c21-19-15-7-3-1-5-13(15)9-11-17(19)23-24-18-12-10-14-6-2-4-8-16(14)20(18)22/h1-12H,21-22H2
InChIKey
LCXOEQDSHXTPFA-UHFFFAOYSA-N
Compound name
2-[(1-aminonaphthalen-2-yl)disulfanyl]naphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

325
Patents

348.0755 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.08278 171.7
[M+Na]+ 371.06472 182.1
[M-H]- 347.06822 178.9
[M+NH4]+ 366.10932 187.0
[M+K]+ 387.03866 172.7
[M+H-H2O]+ 331.07276 164.5
[M+HCOO]- 393.07370 185.3
[M+CH3COO]- 407.08935 182.5
[M+Na-2H]- 369.05017 177.6
[M]+ 348.07495 173.7
[M]- 348.07605 173.7
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.