CID 46785163

Cyclopropyl(1,3-thiazol-2-yl)methanamine

Structural Information

Molecular Formula
C7H10N2S
SMILES
C1CC1C(C2=NC=CS2)N
InChI
InChI=1S/C7H10N2S/c8-6(5-1-2-5)7-9-3-4-10-7/h3-6H,1-2,8H2
InChIKey
VPWQNPNTMBITDU-UHFFFAOYSA-N
Compound name
cyclopropyl(1,3-thiazol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

154.05647 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.06375 126.0
[M+Na]+ 177.04569 135.4
[M-H]- 153.04919 132.1
[M+NH4]+ 172.09029 142.7
[M+K]+ 193.01963 132.3
[M+H-H2O]+ 137.05373 119.4
[M+HCOO]- 199.05467 145.6
[M+CH3COO]- 213.07032 139.6
[M+Na-2H]- 175.03114 128.7
[M]+ 154.05592 127.6
[M]- 154.05702 127.6
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

patents stripe