CID 57477561

941685-08-1

Structural Information

Molecular Formula
C13H19BrN2OSi
SMILES
C[Si](C)(C)CCOCN1C=CC2=C(C=CN=C21)Br
InChI
InChI=1S/C13H19BrN2OSi/c1-18(2,3)9-8-17-10-16-7-5-11-12(14)4-6-15-13(11)16/h4-7H,8-10H2,1-3H3
InChIKey
DRANOGPOHXHUQP-UHFFFAOYSA-N
Compound name
2-[(4-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

264
Patents

326.045 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.05228 169.1
[M+Na]+ 349.03422 181.9
[M-H]- 325.03772 174.0
[M+NH4]+ 344.07882 188.5
[M+K]+ 365.00816 170.3
[M+H-H2O]+ 309.04226 168.2
[M+HCOO]- 371.04320 187.7
[M+CH3COO]- 385.05885 202.7
[M+Na-2H]- 347.01967 176.0
[M]+ 326.04445 192.7
[M]- 326.04555 192.7
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