CID 208075

31634-24-9

Structural Information

Molecular Formula
C10H17NOS
SMILES
CC(C)NC(C)C(C1=CC=CS1)O
InChI
InChI=1S/C10H17NOS/c1-7(2)11-8(3)10(12)9-5-4-6-13-9/h4-8,10-12H,1-3H3
InChIKey
CNKXVLUQMBFIRE-UHFFFAOYSA-N
Compound name
2-(propan-2-ylamino)-1-thiophen-2-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.10309 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.11037 146.2
[M+Na]+ 222.09231 153.8
[M+NH4]+ 217.13691 154.3
[M+K]+ 238.06625 149.4
[M-H]- 198.09581 147.3
[M+Na-2H]- 220.07776 149.4
[M]+ 199.10254 147.7
[M]- 199.10364 147.7
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.