CID 155289839

1-(bromomethoxy)-4-styrylbenzene

Structural Information

Molecular Formula
C15H13BrO
SMILES
C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)OCBr
InChI
InChI=1S/C15H13BrO/c16-12-17-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-11H,12H2/b7-6+
InChIKey
SEPSPORLXWTDGZ-VOTSOKGWSA-N
Compound name
1-(bromomethoxy)-4-[(E)-2-phenylethenyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.01498 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.02226 157.9
[M+Na]+ 311.00420 168.3
[M-H]- 287.00770 166.7
[M+NH4]+ 306.04880 177.1
[M+K]+ 326.97814 156.0
[M+H-H2O]+ 271.01224 157.1
[M+HCOO]- 333.01318 179.8
[M+CH3COO]- 347.02883 196.3
[M+Na-2H]- 308.98965 165.5
[M]+ 288.01443 177.0
[M]- 288.01553 177.0
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

No patent data available for this compound.