CID 58431163

Cyclopropanecarbothioamide, 1-amino-, hydrochloride (1:1)

Structural Information

Molecular Formula
C4H8N2S
SMILES
C1CC1(C(=S)N)N
InChI
InChI=1S/C4H8N2S/c5-3(7)4(6)1-2-4/h1-2,6H2,(H2,5,7)
InChIKey
SBRAFJGHQSNZEC-UHFFFAOYSA-N
Compound name
1-aminocyclopropane-1-carbothioamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

116.04082 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.04810 115.5
[M+Na]+ 139.03004 124.2
[M-H]- 115.03354 119.5
[M+NH4]+ 134.07464 134.2
[M+K]+ 155.00398 121.9
[M+H-H2O]+ 99.038080 110.9
[M+HCOO]- 161.03902 134.4
[M+CH3COO]- 175.05467 174.9
[M+Na-2H]- 137.01549 119.9
[M]+ 116.04027 115.0
[M]- 116.04137 115.0
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