CID 2794260

3-allyl-6-methylbenzo[d]thiazol-2(3h)-imine hydrobromide

Structural Information

Molecular Formula
C11H12N2S
SMILES
CC1=CC2=C(C=C1)N(C(=N)S2)CC=C
InChI
InChI=1S/C11H12N2S/c1-3-6-13-9-5-4-8(2)7-10(9)14-11(13)12/h3-5,7,12H,1,6H2,2H3
InChIKey
DICUTMLEOKPECA-UHFFFAOYSA-N
Compound name
6-methyl-3-prop-2-enyl-1,3-benzothiazol-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.07211 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.07939 143.6
[M+Na]+ 227.06133 157.1
[M+NH4]+ 222.10593 153.0
[M+K]+ 243.03527 149.0
[M-H]- 203.06483 146.6
[M+Na-2H]- 225.04678 149.7
[M]+ 204.07156 146.8
[M]- 204.07266 146.8
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.

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No patent data available for this compound.