CID 45785902

1311413-01-0

Structural Information

Molecular Formula
C11H19BN2O2S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CSC(=N2)N(C)C
InChI
InChI=1S/C11H19BN2O2S/c1-10(2)11(3,4)16-12(15-10)8-7-17-9(13-8)14(5)6/h7H,1-6H3
InChIKey
UUWOUAFFIVLGHY-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

254.12602 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.13330 150.5
[M+Na]+ 277.11524 160.2
[M-H]- 253.11874 159.7
[M+NH4]+ 272.15984 172.8
[M+K]+ 293.08918 161.9
[M+H-H2O]+ 237.12328 146.9
[M+HCOO]- 299.12422 168.4
[M+CH3COO]- 313.13987 197.8
[M+Na-2H]- 275.10069 152.8
[M]+ 254.12547 157.2
[M]- 254.12657 157.2
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