CID 6366532

94291-65-3

Structural Information

Molecular Formula
C6H13NOS2
SMILES
C/C(=N/O)/C(C)(SC)SC
InChI
InChI=1S/C6H13NOS2/c1-5(7-8)6(2,9-3)10-4/h8H,1-4H3/b7-5-
InChIKey
OCKMYMYYFVZHNS-ALCCZGGFSA-N
Compound name
(NZ)-N-[3,3-bis(methylsulfanyl)butan-2-ylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.04385 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.05113 141.0
[M+Na]+ 202.03307 148.6
[M+NH4]+ 197.07767 149.0
[M+K]+ 218.00701 140.7
[M-H]- 178.03657 140.6
[M+Na-2H]- 200.01852 142.6
[M]+ 179.04330 142.7
[M]- 179.04440 142.7
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.