CID 51664087

2-methyl-2-(thiophen-2-yl)propan-1-amine

Structural Information

Molecular Formula
C8H13NS
SMILES
CC(C)(CN)C1=CC=CS1
InChI
InChI=1S/C8H13NS/c1-8(2,6-9)7-4-3-5-10-7/h3-5H,6,9H2,1-2H3
InChIKey
GULSTDWKCMPQQZ-UHFFFAOYSA-N
Compound name
2-methyl-2-thiophen-2-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

155.07687 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.084146 133.8
[M+Na]+ 178.066088 141.6
[M-H]- 154.069594 137.4
[M+NH4]+ 173.110693 156.9
[M+K]+ 194.040028 139.3
[M+H-H2O]+ 138.074130 128.8
[M+HCOO]- 200.075071 152.9
[M+CH3COO]- 214.090721 176.8
[M+Na-2H]- 176.051536 136.7
[M]+ 155.07632142 134.1
[M]- 155.07741858 134.1
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