CID 124089

3-thiophenamine, n-(2-methoxy-1-methylethyl)-2,4-dimethyl-

Structural Information

Molecular Formula
C10H17NOS
SMILES
CC1=CSC(=C1NC(C)COC)C
InChI
InChI=1S/C10H17NOS/c1-7-6-13-9(3)10(7)11-8(2)5-12-4/h6,8,11H,5H2,1-4H3
InChIKey
MKTFWDHZGUUGQZ-UHFFFAOYSA-N
Compound name
N-(1-methoxypropan-2-yl)-2,4-dimethylthiophen-3-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

21
Patents

199.10309 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.11037 145.7
[M+Na]+ 222.09231 155.4
[M+NH4]+ 217.13691 154.5
[M+K]+ 238.06625 149.4
[M-H]- 198.09581 147.9
[M+Na-2H]- 220.07776 149.7
[M]+ 199.10254 148.1
[M]- 199.10364 148.1
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