CID 15611175

[1-(thiophen-2-yl)cyclopropyl]methanamine

Structural Information

Molecular Formula
C8H11NS
SMILES
C1CC1(CN)C2=CC=CS2
InChI
InChI=1S/C8H11NS/c9-6-8(3-4-8)7-2-1-5-10-7/h1-2,5H,3-4,6,9H2
InChIKey
ZDLQKYNEHHPKBK-UHFFFAOYSA-N
Compound name
(1-thiophen-2-ylcyclopropyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

153.06122 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.06850 123.8
[M+Na]+ 176.05044 133.6
[M-H]- 152.05394 131.3
[M+NH4]+ 171.09504 143.6
[M+K]+ 192.02438 131.0
[M+H-H2O]+ 136.05848 118.9
[M+HCOO]- 198.05942 144.7
[M+CH3COO]- 212.07507 138.2
[M+Na-2H]- 174.03589 128.6
[M]+ 153.06067 126.3
[M]- 153.06177 126.3
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