CID 3056611

73812-42-7

Structural Information

Molecular Formula
C11H15NOS
SMILES
CC1CCCC1(C2=CSC=C2)C(=O)N
InChI
InChI=1S/C11H15NOS/c1-8-3-2-5-11(8,10(12)13)9-4-6-14-7-9/h4,6-8H,2-3,5H2,1H3,(H2,12,13)
InChIKey
WLCBLDVPKPQCSC-UHFFFAOYSA-N
Compound name
2-methyl-1-thiophen-3-ylcyclopentane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.08743 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.09471 148.0
[M+Na]+ 232.07665 155.3
[M-H]- 208.08015 154.6
[M+NH4]+ 227.12125 172.3
[M+K]+ 248.05059 152.5
[M+H-H2O]+ 192.08469 143.3
[M+HCOO]- 254.08563 166.7
[M+CH3COO]- 268.10128 184.6
[M+Na-2H]- 230.06210 146.9
[M]+ 209.08688 146.6
[M]- 209.08798 146.6
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.