CID 3048366

Zinc allyl dithio carbamate

Structural Information

Molecular Formula
C4H7NS2
SMILES
C=CCNC(=S)S
InChI
InChI=1S/C4H7NS2/c1-2-3-5-4(6)7/h2H,1,3H2,(H2,5,6,7)
InChIKey
UTNGOTDJKTYZDV-UHFFFAOYSA-N
Compound name
prop-2-enylcarbamodithioic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

641
Patents

133.002 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.009276 123.2
[M+Na]+ 155.991218 130.5
[M-H]- 131.994724 123.6
[M+NH4]+ 151.035823 145.2
[M+K]+ 171.965158 127.1
[M+H-H2O]+ 115.999260 118.1
[M+HCOO]- 178.000201 136.0
[M+CH3COO]- 192.015851 173.2
[M+Na-2H]- 153.976666 124.1
[M]+ 133.00145142 123.3
[M]- 133.00254858 123.3
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