CID 107298402

N-[(thiolan-3-yl)methyl]formamide

Structural Information

Molecular Formula
C6H11NOS
SMILES
C1CSCC1CNC=O
InChI
InChI=1S/C6H11NOS/c8-5-7-3-6-1-2-9-4-6/h5-6H,1-4H2,(H,7,8)
InChIKey
NCDNEUNGXCTNPS-UHFFFAOYSA-N
Compound name
N-(thiolan-3-ylmethyl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.05614 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.06342 129.7
[M+Na]+ 168.04536 136.0
[M-H]- 144.04886 133.0
[M+NH4]+ 163.08996 152.9
[M+K]+ 184.01930 134.5
[M+H-H2O]+ 128.05340 124.3
[M+HCOO]- 190.05434 149.1
[M+CH3COO]- 204.06999 172.9
[M+Na-2H]- 166.03081 132.1
[M]+ 145.05559 128.6
[M]- 145.05669 128.6
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

No patent data available for this compound.