CID 46342

64011-63-8

Structural Information

Molecular Formula
C9H19N3S
SMILES
CC1CCC(CC1)N=NSCCN
InChI
InChI=1S/C9H19N3S/c1-8-2-4-9(5-3-8)11-12-13-7-6-10/h8-9H,2-7,10H2,1H3
InChIKey
MKDFDANFAFIUAW-UHFFFAOYSA-N
Compound name
2-[(4-methylcyclohexyl)diazenyl]sulfanylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.12997 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.13725 143.8
[M+Na]+ 224.11919 147.8
[M-H]- 200.12269 148.6
[M+NH4]+ 219.16379 163.6
[M+K]+ 240.09313 146.0
[M+H-H2O]+ 184.12723 136.5
[M+HCOO]- 246.12817 164.0
[M+CH3COO]- 260.14382 195.1
[M+Na-2H]- 222.10464 146.2
[M]+ 201.12942 141.6
[M]- 201.13052 141.6
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.