CID 3048067

Hydrazine, 1-(benzylthio)-2-(4-pyridylmethyl)-

Structural Information

Molecular Formula
C13H15N3S
SMILES
C1=CC=C(C=C1)CSNNCC2=CC=NC=C2
InChI
InChI=1S/C13H15N3S/c1-2-4-13(5-3-1)11-17-16-15-10-12-6-8-14-9-7-12/h1-9,15-16H,10-11H2
InChIKey
LKBDPACEXMCUNX-UHFFFAOYSA-N
Compound name
1-benzylsulfanyl-2-(pyridin-4-ylmethyl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.09866 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.10594 150.9
[M+Na]+ 268.08788 156.8
[M-H]- 244.09138 155.7
[M+NH4]+ 263.13248 166.5
[M+K]+ 284.06182 151.5
[M+H-H2O]+ 228.09592 142.3
[M+HCOO]- 290.09686 171.3
[M+CH3COO]- 304.11251 162.3
[M+Na-2H]- 266.07333 157.8
[M]+ 245.09811 150.8
[M]- 245.09921 150.8
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.