CID 6894250

113875-06-2

Structural Information

Molecular Formula
C9H10N2OS
SMILES
C1CC1C(=O)N/N=C/C2=CC=CS2
InChI
InChI=1S/C9H10N2OS/c12-9(7-3-4-7)11-10-6-8-2-1-5-13-8/h1-2,5-7H,3-4H2,(H,11,12)/b10-6+
InChIKey
WQCIBERJKZYXCC-UXBLZVDNSA-N
Compound name
N-[(E)-thiophen-2-ylmethylideneamino]cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.05139 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.05867 135.6
[M+Na]+ 217.04061 144.1
[M-H]- 193.04411 144.5
[M+NH4]+ 212.08521 152.4
[M+K]+ 233.01455 140.8
[M+H-H2O]+ 177.04865 128.8
[M+HCOO]- 239.04959 159.0
[M+CH3COO]- 253.06524 188.9
[M+Na-2H]- 215.02606 139.3
[M]+ 194.05084 139.2
[M]- 194.05194 139.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.