CID 20497040

4-nonyne, 9-bromo-

Structural Information

Molecular Formula
C9H15Br
SMILES
CCCC#CCCCCBr
InChI
InChI=1S/C9H15Br/c1-2-3-4-5-6-7-8-9-10/h2-3,6-9H2,1H3
InChIKey
SSKGDSYBCKBTBR-UHFFFAOYSA-N
Compound name
9-bromonon-4-yne
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

202.0357 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.04298 133.5
[M+Na]+ 225.02492 146.0
[M-H]- 201.02842 134.7
[M+NH4]+ 220.06952 154.3
[M+K]+ 240.99886 134.6
[M+H-H2O]+ 185.03296 128.4
[M+HCOO]- 247.03390 151.3
[M+CH3COO]- 261.04955 191.9
[M+Na-2H]- 223.01037 140.1
[M]+ 202.03515 146.7
[M]- 202.03625 146.7
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

No patent data available for this compound.