CID 6428451

(e,e)-di-1-propenyl disulfide

Structural Information

Molecular Formula
C6H10S2
SMILES
C/C=C\SS/C=C\C
InChI
InChI=1S/C6H10S2/c1-3-5-7-8-6-4-2/h3-6H,1-2H3/b5-3-,6-4-
InChIKey
FHSDVOJKLYJNCQ-GLIMQPGKSA-N
Compound name
(Z)-1-[[(Z)-prop-1-enyl]disulfanyl]prop-1-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

6
Patents

146.0224 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.029676 126.9
[M+Na]+ 169.011618 134.8
[M-H]- 145.015124 127.3
[M+NH4]+ 164.056223 149.1
[M+K]+ 184.985558 130.9
[M+H-H2O]+ 129.019660 122.1
[M+HCOO]- 191.020601 139.5
[M+CH3COO]- 205.036251 173.3
[M+Na-2H]- 166.997066 127.6
[M]+ 146.02185142 129.2
[M]- 146.02294858 129.2
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

patents stripe