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

19
Patents

116.04082 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.048096 115.5
[M+Na]+ 139.030038 124.2
[M-H]- 115.033544 119.5
[M+NH4]+ 134.074643 134.2
[M+K]+ 155.003978 121.9
[M+H-H2O]+ 99.038080 110.9
[M+HCOO]- 161.039021 134.4
[M+CH3COO]- 175.054671 174.9
[M+Na-2H]- 137.015486 119.9
[M]+ 116.04027142 115.0
[M]- 116.04136858 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