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

7
Patents

146.0224 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.02968 126.9
[M+Na]+ 169.01162 134.8
[M-H]- 145.01512 127.3
[M+NH4]+ 164.05622 149.1
[M+K]+ 184.98556 130.9
[M+H-H2O]+ 129.01966 122.1
[M+HCOO]- 191.02060 139.5
[M+CH3COO]- 205.03625 173.3
[M+Na-2H]- 166.99707 127.6
[M]+ 146.02185 129.2
[M]- 146.02295 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